SCHEMBL30855702

SCHEMBL30855702

COc1ccc(CN2C(=O)c3c(N)ncc(Br)c3C2c2cc(F)ccc2Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
ALDH1A1 P00352 5/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 3/20 0.35
TNIK Q9UKE5 1/20 0.35
HKDC1 Q2TB90 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALOX15 P16050 2/20 0.34
HSD17B10 Q99714 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 2/20 0.34
USP2 O75604 1/20 0.34
CYP1A2 P05177 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
SCHEMBL30855768 0.91 MAPT (0.41) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL31451865 0.84 MAPT (0.39) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL30855986 0.84 MAPT (0.36) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL30856034 0.84 ALDH1A1 (0.37) MAPTALDH1A1KDM4ESMN1; SMN2ALOX15
SCHEMBL30856376 0.83 MAPT (0.37) MAPTALDH1A1MEN1KMT2AGRIN1
SCHEMBL31452004 0.83 MAPT (0.38) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL30856159 0.82 NPBWR1 (0.38) MAPTALDH1A1GRIN1GRIN2BKDM4E
SCHEMBL31451794 0.82 MAPT (0.43) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL30930589 0.82 MAPT (0.39) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL31451876 0.82 MAPT (0.40) MAPTALDH1A1MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120152713-A Tricyclic aryl derivatives and compositions and methods thereof 昂胜医疗科技公司 2025-06-13 CN disclosed
EP-4561562-A2 TRICYCLIC ARYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF Ensem Therapeutics, Inc. (US) 2025-06-04 EP disclosed
WO-2024026128-A2 TRICYCLIC ARYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed