SCHEMBL10187689

SCHEMBL10187689

Cc1ccc2n1CCCC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 10/20 0.38
DRD3 P35462 2/20 0.38
ALDH1A1 P00352 4/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.35
HTT P42858 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL29161593 0.75 ALDH1A1 (0.38) HPGDALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL29161623 0.74 ALDH1A1 (0.40) HPGDALDH1A1GAAMAPTLMNA
SCHEMBL13057511 0.72 NPC1 (0.33) HPGDDRD3ALDH1A1LMNASMN1; SMN2
SCHEMBL14396591 0.72 HPGD (0.33) HPGDLMNAHTTMEN1KMT2A
SCHEMBL26364211 0.71 KDM4E (0.35) DRD3ALDH1A1MAPTMAPK1HTT
SCHEMBL12857421 0.71 HPGD (0.34) HPGDALDH1A1GAALMNASMN1; SMN2
SCHEMBL18152630 0.68 ALDH1A1 (0.38) HPGDALDH1A1GAALMNASMN1; SMN2
SCHEMBL14206904 0.67 HTT (0.49) HPGDDRD3ALDH1A1GAAMAPT
SCHEMBL14396592 0.67 POLB (0.35) HPGDALDH1A1SMN1; SMN2POLBMAPK1
SCHEMBL26386188 0.65 MAPT (0.41) HPGDDRD3ALDH1A1GAAMAPT

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023173016-A1 KRAS INHIBITORS FOR TREATING DISEASE BLOSSOMHILL THERAPEUTICS, INC. (US) 2023-09-14 WO disclosed
WO-2021023292-A1 SUBSTITUTED PYRAZOLYL PYRAZOLE BISAMIDE COMPOUND OR PESTICIDE ACCEPTABLE SALT OR COMPOSITION THEREOF, AND USE THEREOF 海利尔药业集团股份有限公司 2021-02-11 WO disclosed
WO-2019233372-A1 SUBSTITUTED PYRAZOLYL PYRAZOLE SULFONAMIDE COMPOUND OR PESTICIDALLY ACCEPTABLE SALT THEREOF, COMPOSITION AND USE THEREOF 海利尔药业集团股份有限公司 (CN) 2019-12-12 WO disclosed
US-8524756-B2 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2013-09-03 US disclosed
US-8524756-B2 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2013-09-03 US disclosed
US-20130142831-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2013-06-06 US disclosed
US-20130142831-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2013-06-06 US disclosed
US-8314134-B2 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-11-20 US disclosed
US-8163777-B2 Benzimidazolyl-pyridine compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-04-24 US disclosed
US-8163777-B2 Benzimidazolyl-pyridine compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-04-24 US disclosed
US-20100311787-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2010-12-09 US disclosed
US-7709518-B2 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2010-05-04 US disclosed
US-7709518-B2 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2010-05-04 US disclosed
US-20070254912-A1 Benzimidazolyl-pyridine compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. 2007-11-01 US disclosed
US-20070254912-A1 Benzimidazolyl-pyridine compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. 2007-11-01 US disclosed
US-20070249661-A1 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2007-10-25 US disclosed
US-20070249661-A1 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2007-10-25 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 (4 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-20070254912-A1 Benzimidazolyl-pyridine compounds for inflammation and immune-related uses NLRP3, CXCR1, CXCR2 HPGD 1477/4885DRD3 3535/4885ALDH1A1 2568/4885
US-20100311787-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCR2, CXCL8, CCR9 HPGD 1064/4885DRD3 4520/4885ALDH1A1 1952/4885
US-20070249661-A1 Compounds for inflammation and immune-related uses CXCR2, CXCL8, CCR9 HPGD 1064/4885DRD3 4520/4885ALDH1A1 1952/4885
US-20130142831-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCR2, CXCL8, CCR9 HPGD 1064/4885DRD3 4520/4885ALDH1A1 1952/4885

“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.