SCHEMBL24752128

SCHEMBL24752128

CSc1ncc2cc(C(=O)O)[nH]c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ DAO P14920 3/20 0.41
▸ NTRK1 P04629 1/20 0.40
▸ PIN1 Q13526 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ SRD5A2 P31213 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ GPR35 Q9HC97 1/20 0.37
▸ KDM6B O15054 1/20 0.36
▸ KDM4A O75164 1/20 0.36
▸ KDM4D Q6B0I6 1/20 0.36
▸ HIF1AN Q9NWT6 1/20 0.36
▸ KDM2A Q9Y2K7 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ THRB P10828 1/20 0.35

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
SCHEMBL29763764 1.00 MEN1 (0.46) MEN1KMT2ADAONTRK1PIN1
SCHEMBL24752309 0.86 MEN1 (0.39) MEN1KMT2ANTRK1KDM4EALDH1A1
SCHEMBL30853010 0.85 ABL1 (0.42) KDM4E
SCHEMBL24752055 0.85 ABL1 (0.42) KDM4E
SCHEMBL28705638 0.84 FGFR1 (0.40) MEN1KMT2ANTRK1SMN1; SMN2
SCHEMBL20980339 0.84 KDM4E (0.43) MEN1KMT2ANTRK1KDM4EALDH1A1
SCHEMBL28514657 0.81 MEN1 (0.35) MEN1KMT2ANTRK1KDM4EALDH1A1
SCHEMBL10323760 0.81 KDM6B (0.50) MEN1KMT2ANTRK1KDM4EHPGD
SCHEMBL28839534 0.76 DAO (0.45) MEN1KMT2ADAOPIN1KDM4E
SCHEMBL30808517 0.76 DAO (0.45) MEN1KMT2ADAOPIN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117881681-A Substituted pyrrolo [2,3-d ] pyrimidines, their preparation and their therapeutic use 赛诺菲 2024-04-12 — — CN disclosed
WO-2022263472-A1 SUBSTITUTED PYRROLO[2,3-D]PYRIMIDINES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2022-12-22 — — WO disclosed
EP-4105218-A1 SUBSTITUTED PYRROLO[2,3-D] PYRIMIDINES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2022-12-21 — — EP disclosed
CN-113788837-B Trilaciclib synthesis method 深圳湾实验室坪山生物医药研发转化中心 2022-08-26 — — CN disclosed
CN-113788837-A Trilaciclib synthesis method 深圳湾实验室坪山生物医药研发转化中心 2021-12-14 — — CN disclosed
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