SCHEMBL2408044

SCHEMBL2408044

Sc1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.68
MAOA P21397 2/20 0.58
MAOB P27338 2/20 0.58
LTA4H P09960 8/20 0.42
LMNA P02545 2/20 0.42
CYP2A6 P11509 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SCN9A Q15858 1/20 0.41
HAO1 Q9UJM8 1/20 0.41
CA2 P00918 1/20 0.40

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
SCHEMBL7446482 0.95 IDO1 (0.62) IDO1MAOAMAOBLTA4HLMNA
Lithium Ion SCHEMBL7446478 0.93 IDO1 (0.59) IDO1MAOAMAOBLTA4HLMNA
SCHEMBL636168 0.86 ALDH1A1 (0.47) IDO1MAOAMAOBLTA4HALDH1A1
SCHEMBL15929631 0.86 ALDH1A1 (0.47) IDO1MAOAMAOBLTA4HALDH1A1
SCHEMBL457634 0.86 MAOA (0.74) MAOAMAOBLTA4HLMNACYP2A6
SCHEMBL9242729 0.86 MAOA (0.74) MAOAMAOBLTA4HLMNACYP2A6
SCHEMBL9294674 0.86 ALDH1A1 (0.47) IDO1MAOAMAOBLTA4HALDH1A1
SCHEMBL30385926 0.83 MAOA (0.70) MAOAMAOBLTA4HLMNACYP2A6
SCHEMBL48247 0.83
SCHEMBL11540372 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2022-05-24 US disclosed
US-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2021-08-05 US disclosed
EP-2144604-B1 Methods for the treatment of chronic viral hepatitis C using RO 113-0830 CONATUS PHARMACEUTICALS INC (US) 2011-09-21 EP disclosed
US-20110212056-A1 COMBINATION THERAPY FOR THE TREATMENT OF LIVER DISEASES CONATUS PHARMACEUTICALS, INC. 2011-09-01 US disclosed
CN-101668520-A Methods for the treatment of liver diseases CONATUS PHARMACEUTICALS INC 2010-03-10 CN disclosed
EP-2144604-A2 METHODS FOR THE TREATMENT OF LIVER DISEASES USING SPECIFIED MATRIX METALLOPROTEINASE (MMP) INHIBITORS Conatus Pharmaceuticals, Inc. (US) 2010-01-20 EP disclosed
WO-2008106166-A2 METHODS FOR THE TREATMENT OF LIVER DISEASES USING SPECIFIED MATRIX METALLOPROTEINASE (MMP) INHIBITORS CONATUS PHARMACEUTICALS, INC. (US) 2008-09-04 WO disclosed
WO-2008106167-A1 COMBINATION THERAPY COMPRISING MATRIX METALLOPROTEINASE INHIBITORS AND CASPASE INHIBITORS FOR THE TREATMENT OF LIVER DISEASES CONATUS PHARMACEUTICALS, INC. (US) 2008-09-04 WO disclosed
US-20080207569-A1 Methods for the treatment of liver diseases CONATUS PHARMACEUTICALS, INC. 2008-08-28 US disclosed
US-20080207605-A1 Combination therapy for the treatment of liver diseases CONATUS PHARMACEUTICALS, INC. 2008-08-28 US disclosed
US-6110964-A FOR TREATING ARTHRITIS, INFLAMMATORY BOWEL DISEASE, CROHN'S DISEASE, EMPHYSEMA, ACUTE RESPIRATORY DISTRESS SYNDROME, ASTHMA CHRONIC OBSTRUCTIVE PULMONARY DISEASE, ALZHEIMER'S DISEASE, ORGAN TRANSPLANT TOXICITY, CACHEXIA, CANCER PFIZER INC. (US) 2000-08-29 US disclosed
EP-1001930-A2 N-HYDROXYFORMAMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 2000-05-24 EP disclosed
WO-1999067255-A1 PROPENYL CEPHALOSPORIN DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-12-29 WO disclosed
WO-1999052910-A1 BICYCLIC HYDROXAMIC ACID DERIVATIVES PFIZER PRODUCTS INC. (US) 1999-10-21 WO disclosed
WO-1999042436-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED-ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1999-08-26 WO disclosed
US-5932595-A ANTIARTHRITIC AGENT; MULTIPLE SCLEROSIS; OSTEOPOROSIS; RESPIRATORY SYSTEM DISORDERS; SKIN DISORDERS; ANTIULCER AGENT SYNTEX (U.S.A.) INC. (US) 1999-08-03 US disclosed
WO-1999006361-A2 N-HYDROXYFORMAMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1999-02-11 WO disclosed
CN-1160045-A Matrix metalloprotease inhibitors HOFFMANN LA ROCHE (CH) 1997-09-24 CN disclosed
EP-0780386-A1 Matrix metalloprotease inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1997-06-25 EP disclosed
US-4156011-A TREATMENT OF CARDIOVASCULAR DISORDERS SOCIETE ANONYME DITE: LABORATOIRE L. LAFON (FR) 1979-05-22 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 (5 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-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF RHEB, KRAS, NRAS IDO1 2311/4885MAOA 3095/4885MAOB 491/4885
US-20110212056-A1 COMBINATION THERAPY FOR THE TREATMENT OF LIVER DISEASES MMP10, MMP3, GOT2 IDO1 1794/4885MAOA 1119/4885MAOB 784/4885
US-20080207605-A1 Combination therapy for the treatment of liver diseases MMP10, MMP3, GOT2 IDO1 1794/4885MAOA 1119/4885MAOB 784/4885
US-20080207569-A1 Methods for the treatment of liver diseases MMP1, PYGL, MMP8 IDO1 1413/4885MAOA 445/4885MAOB 275/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS IDO1 3778/4885MAOA 4020/4885MAOB 1112/4885

“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.