SCHEMBL30711318

SCHEMBL30711318

O=C(O)c1ccc([C@@H]2CC(c3cnn(CCF)c3)CCN2)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ P2RY14 Q15391 1/20 0.33
▸ EGLN1 Q9GZT9 4/20 0.31
▸ HTR3A P46098 2/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ MLYCD O95822 1/20 0.31
▸ CHRM1 P11229 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ HCAR2 Q8TDS4 1/20 0.30
▸ CHEK1 O14757 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ ALDH1A1 P00352 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
SCHEMBL30711385 0.88 TSHR (0.37) HSD17B10HTR3ATSHRSMN1; SMN2ALDH1A1
SCHEMBL30711388 0.88 TSHR (0.37) HSD17B10HTR3ATSHRSMN1; SMN2ALDH1A1
SCHEMBL30711182 0.87 TSHR (0.42) L3MBTL1HSD17B10P2RY14EGLN1KDM1A
SCHEMBL30711191 0.85 HCAR2 (0.42) L3MBTL1HSD17B10P2RY14EGLN1KDM1A
SCHEMBL30711334 0.81 HCRTR1 (0.36) HSD17B10P2RY14MLYCD
SCHEMBL30711351 0.81 PROKR1 (0.40) P2RY14KDM1AHDAC6
SCHEMBL30711285 0.77 HCAR2 (0.39) P2RY14TSHRHCAR2SMN1; SMN2
SCHEMBL30711259 0.75 AKR1C3 (0.44) P2RY14
SCHEMBL30711292 0.74 P2RY14 (0.42) HSD17B10P2RY14ALDH1A1
SCHEMBL30711363 0.74 HSD11B1 (0.38) P2RY14KDM1A

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
WO-2023246677-A1 INDOLE-PHENYLPIPERIDINE COMPOUND, METHOD FOR PREPARING SAME, AND USE THEREOF 深圳信立泰药业股份有限公司 2023-12-28 — — WO disclosed
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