SCHEMBL38650982

SCHEMBL38650982

Cc1cccc2ccc(N[C@H]3CCCC[C@@H]3Nc3ccc4cccc(C)c4n3)nc12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 4/20 0.40
▸ PIM2 Q9P1W9 4/20 0.40
▸ POLB P06746 1/20 0.38
▸ TAS1R3 Q7RTX0 3/20 0.38
▸ TAS1R1 Q7RTX1 3/20 0.38
▸ TAS1R2 Q8TE23 3/20 0.38
▸ FER P16591 1/20 0.37
▸ SYK P43405 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ AR P10275 1/20 0.36
▸ HCRTR1 O43613 2/20 0.35
▸ HCRTR2 O43614 2/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ELANE P08246 1/20 0.35

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
SCHEMBL23714067 0.75 NCF1 (0.53) PIM1PIM2ARELANE
SCHEMBL1708933 0.74 ALDH1A1 (0.54) SYKKDM4ELMNA
SCHEMBL1699066 0.74 ALDH1A1 (0.54) SYKKDM4ELMNA
SCHEMBL1699050 0.73 NPC1 (0.58) HCRTR1HCRTR2KDM4ELMNASMN1; SMN2
SCHEMBL10619249 0.73 PIM1 (0.51) PIM1PIM2POLBARKDM4E
SCHEMBL1708932 0.73 NPC1 (0.58) HCRTR1HCRTR2KDM4ELMNASMN1; SMN2
SCHEMBL22545406 0.71 CACNA1C (0.42) ARMAP4K4KDM4EELANE
SCHEMBL23714118 0.70 KMT2A (0.55) PIM1PIM2KDM4ELMNASMN1; SMN2
SCHEMBL23714119 0.69 KDM4E (0.50) POLBKDM4ELMNASMN1; SMN2
SCHEMBL23714120 0.68 ELANE (0.50) KDM4ELMNASMN1; SMN2ELANE

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
CN-122011035-A Asymmetric catalytic synthesis of pentavalent oxygen sulphur phosphane monomer and preparation method of intermediate thereof 上海交通大学 2026-05-12 — — CN disclosed
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