SCHEMBL29882977

SCHEMBL29882977

ClN1N=C(c2ccccc2)C=C(c2cc3ccccc3c3ccccc23)N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.39
▸ NISCH Q9Y2I1 1/20 0.35
▸ LMNA P02545 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HPGD P15428 3/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MPI P34949 1/20 0.33
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ CDC25B P30305 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.31
▸ TRPM4 Q8TD43 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
SCHEMBL28606774 1.00 CYP11B1 (0.39) CYP11B1NISCHLMNASMN1; SMN2HPGD
SCHEMBL1389781 0.79 LMNA (0.41) LMNASMN1; SMN2
SCHEMBL28374622 0.78 CYP1A1 (0.38) CYP11B1NISCHSMN1; SMN2MEN1KMT2A
SCHEMBL28843680 0.76 LMNA (0.39) LMNASMN1; SMN2ALDH1A1
SCHEMBL31538680 0.76 LMNA (0.39) LMNASMN1; SMN2ALDH1A1
SCHEMBL28413030 0.69 TYMP (0.36) NISCHLMNASMN1; SMN2HPGDALDH1A1
SCHEMBL30981523 0.69 ALOX5 (0.40) ALOX5
SCHEMBL20395961 0.67 CYP1A2 (0.38) LMNAALDH1A1KDM4EL3MBTL1ESR2
SCHEMBL5851578 0.66 ALDH1A1 (0.63) CYP11B1NISCHSMN1; SMN2HPGDMEN1
SCHEMBL24174562 0.63 ALDH1A1 (0.59) CYP11B1SMN1; SMN2HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118930492-A Ortho-aryl substituted triazine compound and application thereof 烟台显华科技集团股份有限公司 2024-11-12 — — CN disclosed
CN-115109070-A Compound containing indolo-heterocyclic structure and application thereof 烟台显华科技集团股份有限公司 2022-09-27 — — CN disclosed
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