SCHEMBL9794796

SCHEMBL9794796

Cc1csc(N2CCC[N]CC2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ MEN1 O00255 3/20 0.42
▸ HRH3 Q9Y5N1 2/20 0.41
▸ DPP4 P27487 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ OGA O60502 2/20 0.40
▸ AR P10275 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ RAB9A P51151 2/20 0.38
▸ POLB P06746 3/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ PIK3CG P48736 1/20 0.35
▸ NPC1 O15118 1/20 0.34

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
SCHEMBL9794819 0.93 L3MBTL1 (0.47) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL4472290 0.86 L3MBTL1 (0.54) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL3511935 0.86 L3MBTL1 (0.54) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL4469579 0.84 SMN1; SMN2 (0.53) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL3551633 0.77 ALDH1A1 (0.49) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL9794803 0.75 BAZ2A (0.48) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL1713003 0.75 L3MBTL1 (0.47) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL6929063 0.75 ALDH1A1 (0.54) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL2228747 0.74 BAZ2A (0.49) L3MBTL1MEN1HRH3DPP4SMN1; SMN2
SCHEMBL4463690 0.74 LMNA (0.68) MEN1SMN1; SMN2ARLMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4987133-A Salicylic acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-01-22 — — US claimed
EP-0338352-A2 Salicylic acid derivatives MERCK PATENT GmbH (DE) 1989-10-25 — — EP claimed
US-4987133-A Salicylic acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-01-22 — — US disclosed
US-4987133-A Salicylic acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-01-22 — — US disclosed
EP-0338352-A3 SALICYLIC ACID DERIVATIVES MERCK PATENT GmbH (DE) 1990-03-14 — — EP disclosed
EP-0338352-A2 Salicylic acid derivatives MERCK PATENT GmbH (DE) 1989-10-25 — — EP disclosed
EP-0338352-A2 Salicylic acid derivatives MERCK PATENT GmbH (DE) 1989-10-25 — — EP disclosed
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