SCHEMBL25590740

SCHEMBL25590740

Cc1cc(I)n2ncc(C(F)(F)F)c2n1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ POLB P06746 2/20 0.42
▸ HPGD P15428 3/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ PDE2A O00408 6/20 0.37
▸ KDM4E B2RXH2 3/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34

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
SCHEMBL25590741 0.72 KDM4E (0.37) HSD17B10MAPTHPGDMEN1KMT2A
SCHEMBL13901524 0.65 KDM4E (0.38) HSD17B10MAPTPOLBHPGDMEN1
SCHEMBL23508151 0.64 HSP90AB1 (0.32) —
SCHEMBL11605145 0.63 KDM4E (0.57) HSD17B10MAPTPOLBHPGDMEN1
SCHEMBL14194710 0.62 LRRK2 (0.32) CYP1A2
SCHEMBL15550558 0.62 PDE10A (0.50) CYP1A2HTT
SCHEMBL1007301 0.62 KDM4E (0.56) HSD17B10MAPTPOLBHPGDMEN1
SCHEMBL24582690 0.61 HPGD (0.44) HSD17B10HPGDMEN1KMT2AKDM4E
SCHEMBL25096433 0.61 GRM5 (0.41) HSD17B10HPGDKDM4EHTTTSHR
SCHEMBL20542245 0.61 LMNA (0.41) MAPTPOLBPDE2AHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4186895-A1 COMPOUND USEFUL AS CDK7 KINASE INHIBITOR AND USE THEREOF TYK Medicines Inc. (CN) 2023-05-31 — — EP disclosed
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