SCHEMBL510599

SCHEMBL510599

O=Cc1ccc(OCc2ccccc2)nc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.46
FFAR1 O14842 1/20 0.46
CCNB2 O95067 2/20 0.45
CDK1 P06493 2/20 0.45
CDK4 P11802 2/20 0.45
CCNB1 P14635 2/20 0.45
CCND1 P24385 2/20 0.45
CCNB3 Q8WWL7 2/20 0.45
CXCR2 P25025 1/20 0.44
POLB P06746 1/20 0.43
GABRP O00591 1/20 0.43
GABRD O14764 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRG2 P18507 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31624114 1.00 MAOA (0.53) MAOAMAOBL3MBTL1ALDH1A1KDM4E
SCHEMBL510015 0.83 ALDH1A1 (0.65) MAOAMAOBL3MBTL1ALDH1A1KDM4E
SCHEMBL16838825 0.83 KDM4E (0.65) MAOAMAOBL3MBTL1ALDH1A1KDM4E
SCHEMBL16838832 0.83 TACR2 (0.52) MAOAMAOBL3MBTL1ALDH1A1KDM4E
SCHEMBL24365645 0.83 GABRP (0.43) MAOAMAOBALDH1A1KDM4EPKM
SCHEMBL30471078 0.83 GABRP (0.43) MAOAMAOBALDH1A1KDM4EPKM
SCHEMBL3006684 0.81 MAOA (0.43) MAOAMAOBL3MBTL1ALDH1A1KDM4E
SCHEMBL19405966 0.81 MAOB (0.63) MAOAMAOBL3MBTL1ALDH1A1KDM4E
SCHEMBL3002842 0.80 MAOA (0.42) MAOAMAOBL3MBTL1ALDH1A1KDM4E
SCHEMBL437173 0.80 LMNA (0.49) L3MBTL1ALDH1A1RAB9AACACBACACA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 105 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240398770-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2024-12-05 US disclosed
US-12036210-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia ATROGI AB (SE) 2024-07-16 US disclosed
US-12036210-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia ATROGI AB (SE) 2024-07-16 US disclosed
US-12036210-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia ATROGI AB (SE) 2024-07-16 US disclosed
US-11357757-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia ATROGI AB (SE) 2022-06-14 US disclosed
US-11357757-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia ATROGI AB (SE) 2022-06-14 US disclosed
US-20220133703-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2022-05-05 US disclosed
US-20220133703-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2022-05-05 US disclosed
EP-3971168-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA Atrogi AB (SE) 2022-03-23 EP disclosed
EP-3681872-B1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2021-11-17 EP disclosed
US-20050187266-A1 Alpha substituted carboxylic acids PFIZER INC 2005-08-25 US disclosed
WO-2005065779-A1 CALCITONIN GENE RELATED PEPTIDE RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-07-21 WO disclosed
EP-1539766-A1 CALCITONIN GENE RELATED PEPTIDE RECEPTOR ANTAGONISTS Bristol-Myers Squibb Company (US) 2005-06-15 EP disclosed
WO-2005016862-A1 SUBSTITUTED ARYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORPORATION (JP) 2005-02-24 WO disclosed
WO-2004092145-A1 ALPHA SUBSTITUTED CARBOXYLIC ACID AS PPAR MODULATORS PFIZER INC. (US) 2004-10-28 WO disclosed
US-20040204397-A1 Calcitonin gene related peptide receptor antagonists BRISTOL-MYERS SQUIBB COMPANY 2004-10-14 US disclosed
US-20040063735-A1 Calcitonin gene related peptide receptor antagonists BRISTOL-MYERS SQUIBB COMPANY 2004-04-01 US disclosed
WO-2003104236-A1 CALCITONIN GENE RELATED PEPTIDE RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-12-18 WO disclosed
CN-1420881-A Beta-amino acid derivs. as inhibitors of matrix metalloproteases and TNF-alpha BRISTOL MYERS SQUIBB PHARMACEU (US) 2003-05-28 CN disclosed
US-6495565-B2 FOR THERAPY OF ACUTE INFECTION, ACUTE PHASE RESPONSE, AGE RELATED MACULAR DEGENERATION, ALCOHOLISM, ANOREXIA, ASTHMA, AUTOIMMUNE DISEASE, AUTOIMMUNE HEPATITIS, BECHET'S DISEASE, CACHEXIA, CALCIUM PYROPHOSPHATE DIHYDRTATE DEPOSITION BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-12-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040063735-A1 Calcitonin gene related peptide receptor antagonists CALCRL, CALCA, CALCR MAOA 966/4885MAOB 1012/4885L3MBTL1 4593/4885
US-20220133703-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA SLC5A2, SLC5A1, GPR119 MAOA 1376/4885MAOB 739/4885L3MBTL1 2857/4885
US-11357757-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia SLC5A2, SLC5A1, GPR119 MAOA 1376/4885MAOB 739/4885L3MBTL1 2857/4885
US-20240398770-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA SLC5A2, SLC5A1, GPR119 MAOA 1561/4885MAOB 903/4885L3MBTL1 3006/4885
US-20050187266-A1 Alpha substituted carboxylic acids PPARG, PPARA, PPARD MAOA 4010/4885MAOB 4032/4885L3MBTL1 2918/4885
US-12036210-B2 Heteroaryl substituted beta-hydroxyethylamines for use in treating hyperglycaemia SLC5A2, SLC5A1, GPR119 MAOA 1376/4885MAOB 739/4885L3MBTL1 2857/4885
US-20040204397-A1 Calcitonin gene related peptide receptor antagonists CALCRL, CALCA, CALCR MAOA 966/4885MAOB 1012/4885L3MBTL1 4593/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.