SCHEMBL103159

SCHEMBL103159

COc1cc[nH]c(=O)c1C#N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
CYP2C9 P11712 1/20 0.49
MCL1 Q07820 1/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 3/20 0.39
PIM1 P11309 2/20 0.39
GLA P06280 2/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 3/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
USP2 O75604 1/20 0.37
POLB P06746 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL11021220 0.76 HSD11B1 (0.46) HTTALDH1A1KDM4EGLAGAA
SCHEMBL296497 0.75 KDM4E (0.45) LMNAMCL1ALDH1A1KDM4EGLA
SCHEMBL11027019 0.74 CA2 (0.47) MAPTCYP2C9HTTALDH1A1KDM4E
SCHEMBL1162742 0.74 PIM1 (0.54) MAPTALDH1A1KDM4EPIM1GLA
SCHEMBL7064467 0.73 MAPT (0.53) MAPTLMNACYP2C9HTTALDH1A1
SCHEMBL31124656 0.73 MAPT (0.53) MAPTLMNACYP2C9HTTALDH1A1
SCHEMBL18257252 0.72 PDE3B (0.40) MAPTMCL1HTTALDH1A1KDM4E
SCHEMBL8165980 0.72 MAPT (0.46) MAPTLMNAMCL1ALDH1A1KDM4E
SCHEMBL25210536 0.71 PRKCQ (0.39) MAPTLMNACYP2C9ALDH1A1KDM4E
SCHEMBL10340373 0.71 MTNR1A (0.43) MAPTLMNACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115504904-A Gelmethine intermediate compound and preparation method thereof 山东新时代药业有限公司 2022-12-23 CN claimed
CN-115504906-A Gelmethylpyrimidine intermediate compound 山东新时代药业有限公司 2022-12-23 CN claimed
US-20250084395-A1 ENGINEERED NITRILASES FOR BIOCATALYSIS KCAT ENZYMATIC PRIVATE LIMITED (IN) 2025-03-13 US disclosed
EP-4219463-B1 TERPYRIDINE DIKETONE COMPOUND OR SALT THEREOF, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHENZHEN SALUBRIS PHARM CO LTD (CN) 2025-01-15 EP disclosed
US-20240166627-A1 Terpyridinedione compound or salt thereof, and preparation method and application thereof SHENZHEN SALUBRIS PHARMACEUTICALS CO., LTD. (CN) 2024-05-23 US disclosed
CN-116648244-B Terpyridyl dione compound or salt thereof, and preparation method and application thereof 深圳信立泰药业股份有限公司 2023-12-15 CN disclosed
CN-116648244-A Terpyridyl dione compound or salt thereof, and preparation method and application thereof 深圳信立泰药业股份有限公司 2023-08-25 CN disclosed
EP-4219463-A1 TERPYRIDINE DIKETONE COMPOUND OR SALT THEREOF, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Salubris Pharmaceuticals Co., Ltd. (CN) 2023-08-02 EP disclosed
EP-4219463-A1 TERPYRIDINE DIKETONE COMPOUND OR SALT THEREOF, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Salubris Pharmaceuticals Co., Ltd. (CN) 2023-08-02 EP disclosed
WO-2023109954-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed
WO-2023016535-A1 TERPYRIDINE DIKETONE COMPOUND OR SALT THEREOF, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳信立泰药业股份有限公司 2023-02-16 WO disclosed
US-20050176775-A1 Substituted pyridinones PHARMACIA CORPORATION 2005-08-11 US disclosed
EP-0946550-B1 PREPARATION OF [1S-[1a,2b,3b,4a(S*)]]-4-[7-[[1-(3-CHLORO-2-THIENYL)METHYL]PROPYL]AMINO]-3H-IMIDAZO[4,5-b]PYRIDIN-3-yl]-N-ETHYL-2,3-DIHYDROXYCYCLOPENTANECARBOXAMIDE AVENTIS PHARMA INC (US) 2005-08-03 EP disclosed
WO-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed
US-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 US disclosed
EP-0946550-A4 PREPARATION OF 1S- 1a,2b,3b,4a(S*)]]-4- 7- 1-(3-CHLORO-2-THIENYL) METHYL]PROPYL]AMINO]-3H-IMIDAZO 4,5-b]PYRIDIN-3-yl]-N-ETHYL-2,3-DIHYDROXYCYCLOPENTANECARBOXAMIDE AVENTIS PHARM PROD INC (US) 2003-05-14 EP disclosed
US-6235909-B1 HYDROLYZING AND DECARBOXYLATING 2-HYDROXY-3-CYANO-4-METHOXY PYRIDINE TO GIVE 2,4-DIHYDROXYPYRIDINE, FOLLOWED BY NITRATION TO PREPARE 4-HYDROXY-3-NITRO-2(1H)-PYRIDONE AVENTIS PHARMACEUTICALS PRODUCTS INC. 2001-05-22 US disclosed
US-6143894-A Preparation of [1S-[1A,2B,3B,4A(S*)]]-4-[7-[[1-(3-chloro-2-thienyl)methyl propyl]amino] -3H-imidazo[4,5-B]pyridin-3-yl]-N-ethyl-2,3-dihydroxycyclopentanecarboxa mide AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-11-07 US disclosed
EP-0946550-A1 PREPARATION OF 1S- 1a,2b,3b,4a(S*)]]-4- 7- 1-(3-CHLORO-2-THIENYL) METHYL]PROPYL]AMINO]-3H-IMIDAZO 4,5-b]PYRIDIN-3-yl]-N-ETHYL-2,3-DIHYDROXYCYCLOPENTANECARBOXAMIDE RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-10-06 EP disclosed
WO-1998025921-A1 PREPARATION OF [1S-[1a,2b,3b,4a(S*)]]-4-[7-[[1-(3-CHLORO-2-THIENYL) METHYL]PROPYL]AMINO]-3H-IMIDAZO[4,5-b]PYRIDIN-3-yl]-N-ETHYL-2,3-DIHYDROXYCYCLOPENTANECARBOXAMIDE RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-06-18 WO 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 (3 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-20240166627-A1 Terpyridinedione compound or salt thereof, and preparation method and application thereof TNF, MAPKAPK2, MAPK1 MAPT 3206/4885LMNA 4712/4885CYP2C9 912/4885
US-20040058964-A1 Substituted pyridinones MAPK1, MAPK6, MAPK7 MAPT 2803/4885LMNA 1815/4885CYP2C9 1124/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 MAPT 2543/4885LMNA 1884/4885CYP2C9 697/4885

“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.