SCHEMBL29586580

SCHEMBL29586580

Cc1cc(-c2cc(C(=O)N3CCCCC3)n[nH]2)c(Cl)cn1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.42
▸ NPC1 O15118 12/20 0.41
▸ RAB9A P51151 12/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ SENP8 Q96LD8 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP6 Q9GZR1 1/20 0.41
▸ ALPL P05186 4/20 0.41
▸ HPGD P15428 2/20 0.41
▸ KLF5 Q13887 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ SMO Q99835 1/20 0.39

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
SCHEMBL29585365 0.86 RAB9A (0.40) NPC1RAB9AALPLHPGDSMN1; SMN2
SCHEMBL24423862 0.86 RAB9A (0.41) RAB9AHPGDMEN1KMT2AALDH1A1
SCHEMBL24424425 0.85 NPC1 (0.42) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL30630493 0.83 NPC1 (0.43) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL24422926 0.83 NPC1 (0.43) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL30683708 0.77 NPC1 (0.65) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL24423922 0.76 KMT2A (0.51) MEN1KMT2AALDH1A1
SCHEMBL29583326 0.76 KMT2A (0.51) MEN1KMT2AALDH1A1
SCHEMBL24423548 0.73 KDM5A (0.51) HPGDMEN1KMT2AALDH1A1
SCHEMBL24422914 0.73 ALDH1A1 (0.39) RAB9AHPGDMEN1KMT2AALDH1A1

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
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 — — EP disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 — — WO disclosed
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