SCHEMBL1605930

SCHEMBL1605930

COc1ccncc1C=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
TSHR P16473 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
TLR2 O60603 1/20 0.43
TLR1 Q15399 1/20 0.43
TLR6 Q9Y2C9 1/20 0.43
MAPT P10636 1/20 0.42
PRKDC P78527 1/20 0.41
CYP1A1 P04798 3/20 0.41
CYP1A2 P05177 3/20 0.41
CYP1B1 Q16678 3/20 0.41
CYP2D6 P10635 2/20 0.41
CYP3A4 P08684 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL30937481 1.00 ERN1 (0.49) ERN1CA12CA1CA2CA9
SCHEMBL6188476 0.91 CA12 (0.46) ERN1CA12CA1CA2CA9
SCHEMBL29935810 0.84 ERN1 (0.49) ERN1CA12CA1CA2CA9
SCHEMBL1052852 0.84 ERN1 (0.49) ERN1CA12CA1CA2CA9
SCHEMBL25403169 0.82 CA12 (0.46) CA12CA1CA2CA9ALDH1A1
SCHEMBL16096641 0.80 ALDH1A1 (0.38) ERN1CA12CA1CA2CA9
SCHEMBL26119644 0.79 ALDH1A3 (0.39) ERN1CA12CA1CA2CA9
SCHEMBL17895679 0.79 CA12 (0.53) CA12CA1CA2CA9ALDH1A1
SCHEMBL21484579 0.78 CYP3A4 (0.47) CA12CA1CA2CA9ALDH1A1
SCHEMBL26844605 0.78 SLC22A12 (0.51) ERN1ALDH1A1TSHRTDP1TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11905272-B1 3-(2-(4-methoxypyridin-3-yl)-4,5-diphenyl-1H-imidazol-1-yl)-N,N-dimethylpropan-1-amine as an anti-cancer compound King Faisal University (SA) 2024-02-20 US claimed
EP-1611102-A4 USING ALKYLMETAL REAGENTS FOR DIRECTED METALATION OF AZAAROMATICS FMC CORP (US) 2009-04-01 EP claimed
US-7129360-B2 Using alkylmetal reagents for directed metalation of azaaromatics FMC CORPORATION (US) 2006-10-31 US claimed
EP-1611102-A2 USING ALKYLMETAL REAGENTS FOR DIRECTED METALATION OF AZAAROMATICS FMC CORPORATION (US) 2006-01-04 EP claimed
US-20040230055-A1 Using alkylmetal reagents for directed metalation of azaaromatics FMC CORPORATION 2004-11-18 US claimed
WO-2004092125-A2 USING ALKYLMETAL REAGENTS FOR DIRECTED METALATION OF AZAAROMATICS FMC CORPORATION (US) 2004-10-28 WO claimed
EP-4629988-A1 DERIVATIVES OF INDOLE FOR THE TREATMENT OF CANCER AND INFECTIONS Centre National de la Recherche Scientifique (FR) 2025-10-15 EP disclosed
US-20250084052-A1 3-(2-(4-METHOXYPYRIDIN-3-YL)-4,5-DIPHENYL-1H-IMIDAZOL-1-YL)-N,N-DIMETHYLPROPAN-1-AMINE AS AN ANTI-CANCER COMPOUND King Faisal University (SA) 2025-03-13 US disclosed
CN-118359638-A Compound serving as RET kinase inhibitor and preparation method and application thereof 苏州朗睿生物医药有限公司 2024-07-19 CN disclosed
WO-2024121072-A1 DERIVATIVES OF INDOLE FOR THE TREATMENT OF CANCER AND INFECTIONS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2024-06-13 WO disclosed
US-11905272-B1 3-(2-(4-methoxypyridin-3-yl)-4,5-diphenyl-1H-imidazol-1-yl)-N,N-dimethylpropan-1-amine as an anti-cancer compound King Faisal University (SA) 2024-02-20 US disclosed
CN-112041311-B PD-1/PD-L1 inhibitors 吉利德科学公司 2023-10-03 CN disclosed
CN-114502556-B Biphenyl fluoro double bond derivative, preparation method thereof and application thereof in pharmacy 上海和誉生物医药科技有限公司 2023-07-28 CN disclosed
EP-0659737-B1 Catecholamine surrogates useful as beta 3 agonists BRISTOL MYERS SQUIBB CO (US) 2003-03-26 EP disclosed
EP-0714395-B1 VASOCONSTRICTIVE SUBSTITUTED DIHYDROPYRANOPYRIDINES JANSSEN PHARMACEUTICA NV (BE) 1999-03-31 EP disclosed
US-5776983-A ANTIDIABETIC AGENTS, OBESITY, GASTROINTESTINAL DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-07-07 US disclosed
US-5691344-A Vasoconstrictive substituted dihydropyranopyridines JANSSEN PHARMACEUTICA, N.V. (BE) 1997-11-25 US disclosed
EP-0714395-A1 VASOCONSTRICTIVE SUBSTITUTED DIHYDROPYRANOPYRIDINES JANSSEN PHARMACEUTICA N.V. (BE) 1996-06-05 EP disclosed
EP-0659737-A2 Catecholamine surrogates useful as B3 agonists BRISTOL-MYERS SQUIBB COMPANY (US) 1995-06-28 EP disclosed
WO-1995005381-A1 VASOCONSTRICTIVE SUBSTITUTED DIHYDROPYRANOPYRIDINES JANSSEN PHARMACEUTICA N.V. (BE) 1995-02-23 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 (2 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-11905272-B1 3-(2-(4-methoxypyridin-3-yl)-4,5-diphenyl-1H-imidazol-1-yl)-N,N-dimethylpropan-1-amine as an anti-cancer compound H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, API5, MCL1 ERN1 986/4885CA12 4394/4885CA1 4677/4885
US-20250084052-A1 3-(2-(4-METHOXYPYRIDIN-3-YL)-4,5-DIPHENYL-1H-IMIDAZOL-1-YL)-N,N-DIMETHYLPROPAN-1-AMINE AS AN ANTI-CANCER COMPOUND H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, API5, MCL1 ERN1 986/4885CA12 4394/4885CA1 4677/4885

“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.