SCHEMBL24914141

SCHEMBL24914141

c1ccc(-c2nc(-c3ccccc3)nc(-c3c(-c4ccc(C5Nc6ccccc6N5c5ccccc5)cc4)ccc4ccccc34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.38
▸ ALDH1A1 P00352 5/20 0.33
▸ KDM4E B2RXH2 5/20 0.33
▸ HPGD P15428 3/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ ABCB1 P08183 4/20 0.32
▸ TDP1 Q9NUW8 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALOX15 P16050 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL19992839 0.88 RAB9A (0.41) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19369620 0.84 RAB9A (0.44) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL24914358 0.84 RAB9A (0.45) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19369611 0.82 RAB9A (0.39) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL17808183 0.80 RAB9A (0.36) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL18969202 0.80 CYP1A1 (0.37) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22197657 0.80 RAB9A (0.44) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19369615 0.79 RAB9A (0.40) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19870422 0.79 RAB9A (0.38) RAB9AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL21399020 0.78 RAB9A (0.39) RAB9AALDH1A1KDM4EHPGDHSD17B10

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-3351537-B1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2023-01-18 — — EP disclosed
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