SCHEMBL3310740

SCHEMBL3310740

CC(=O)Nc1ccc2cccnc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.63
KMT2A Q03164 5/20 0.63
NPC1 O15118 5/20 0.63
MAPT P10636 4/20 0.63
KDM4E B2RXH2 4/20 0.63
RAB9A P51151 4/20 0.63
GLA P06280 1/20 0.63
TNNI3 P19429 1/20 0.63
TNNT2 P45379 1/20 0.63
TNNC1 P63316 1/20 0.63
RUNX1 Q01196 1/20 0.63
CBFB Q13951 1/20 0.63
PABPC1 P11940 2/20 0.59
P2RY14 Q15391 2/20 0.59
POLB P06746 2/20 0.58
NOTUM Q6P988 1/20 0.57
BAZ1A Q9NRL2 1/20 0.56
TRPV1 Q8NER1 2/20 0.55
OGA O60502 1/20 0.52
ALDH1A1 P00352 3/20 0.50

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
SCHEMBL29728201 0.87 NPC1 (0.77) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL1538297 0.87 NPC1 (0.77) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL27389314 0.87 MEN1 (0.76) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL27528745 0.85 MEN1 (0.63) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL4972667 0.84 MEN1 (0.62) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL22590421 0.83 TRPV1 (0.58) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL21479388 0.83 MEN1 (0.58) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL22860096 0.83 P2RY14 (0.65) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL25547918 0.82 KMT2A (0.67) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL22590411 0.81 P2RY14 (0.62) MEN1KMT2ANPC1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4248975-A2 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME Rigel Pharmaceuticals, Inc. (US) 2023-09-27 EP disclosed
US-11377428-B2 RIP1 inhibitory compounds and methods for making and using the same RIGEL PHARMACEUTICALS, INC. (US) 2022-07-05 US disclosed
US-11370765-B2 RIP1 inhibitory compounds and methods for making and using the same RIGEL PHARMACEUTICALS, INC. (US) 2022-06-28 US disclosed
EP-3473624-B1 NOVEL IMIDAZOPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER DAEGU GYEONGBUK MEDICAL INNOVATION FOUND (KR) 2022-05-11 EP disclosed
WO-2021046437-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2021-03-11 WO disclosed
WO-2021046382-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2021-03-11 WO disclosed
WO-2021046407-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2021-03-11 WO disclosed
US-20210009537-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2021-01-14 US disclosed
US-20210002237-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2021-01-07 US disclosed
EP-3473624-A1 NOVEL IMIDAZOPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER Daegu-Gyeongbuk Medical Innovation Foundation (KR) 2019-04-24 EP disclosed
US-20030114679-A1 Synthesis of enantiomerically pure amino-substituted fused bicyclic rings ANORMED CORPORATION (CA) 2003-06-19 US disclosed
WO-2003022785-A2 SYNTHESIS OF ENANTIOMERICALLY PURE AMINO-SUBSTITUTED FUSED BICYCLIC RINGS ANORMED INC. (CA) 2003-03-20 WO disclosed
EP-1163238-A1 CHEMOKINE RECPETOR BINDING HETEROCYCLIC COMPOUNDS ANORMED INC. (CA) 2001-12-19 EP disclosed
WO-2000056729-A1 CHEMOKINE RECPETOR BINDING HETEROCYCLIC COMPOUNDS ANORMED INC. (CA) 2000-09-28 WO disclosed
US-5405843-A Anticancer drug potentiators MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-04-11 US disclosed
EP-0363212-B1 Novel heterocyclic compounds and anticancer-drug reinforcing agents containing them as effective components MITSUI TOATSU CHEMICALS (JP) 1995-01-04 EP disclosed
US-5204348-A Quinoline derivatives MITSUI TOATSU CHEMICALS INC. (JP) 1993-04-20 US disclosed
EP-0518961-A1 DERIVATIVES OF GLYCINAMIDE, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Aventis Pharma S.A. (FR) 1992-12-23 EP disclosed
US-5112817-A Anticancer Drug Potentiators MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1992-05-12 US disclosed
EP-0363212-A2 Novel heterocyclic compounds and anticancer-drug reinforcing agents containing them as effective components MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-04-11 EP 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-20030114679-A1 Synthesis of enantiomerically pure amino-substituted fused bicyclic rings CBR1, POR, CBR3 MEN1 4063/4885KMT2A 1706/4885NPC1 3716/4885
US-20210009537-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIPK1, RIPK2, RIPK3 MEN1 2540/4885KMT2A 3696/4885NPC1 976/4885
US-20210002237-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIPK1, RIPK2, RIPK3 MEN1 2540/4885KMT2A 3696/4885NPC1 976/4885
US-11377428-B2 RIP1 inhibitory compounds and methods for making and using the same RIPK1, RIPK2, RIPK3 MEN1 2540/4885KMT2A 3696/4885NPC1 976/4885
US-11370765-B2 RIP1 inhibitory compounds and methods for making and using the same RIPK1, RIPK2, RIPK3 MEN1 2540/4885KMT2A 3696/4885NPC1 976/4885

“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.