SCHEMBL26844943

SCHEMBL26844943

Cc1cc(SNC(=O)c2ccc(N3CCN(Cc4ccccc4Br)CC3)cc2)ccc1NCCSc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 17/20 0.45
▸ BCL2 P10415 10/20 0.45
▸ LMNA P02545 2/20 0.41
▸ GALR3 O60755 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38

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
SCHEMBL24619957 0.89 BCL2L1 (0.42) BCL2L1BCL2LMNANPC1RAB9A
SCHEMBL26845024 0.88 BCL2L1 (0.43) BCL2L1BCL2NPC1RAB9A
SCHEMBL26844962 0.88 BCL2L1 (0.47) BCL2L1BCL2
SCHEMBL26680363 0.86 BCL2L1 (0.60) BCL2L1BCL2
SCHEMBL26857118 0.79 BCL2L1 (0.59) BCL2L1BCL2
SCHEMBL26657560 0.77 BCL2L1 (0.75) BCL2L1BCL2
SCHEMBL26657746 0.77 BCL2L1 (0.56) BCL2L1BCL2
SCHEMBL26845031 0.76 BCL2L1 (0.44) BCL2L1BCL2
SCHEMBL21896468 0.76 BCL2L1 (0.59) BCL2L1BCL2
SCHEMBL26846615 0.76 BCL2L1 (0.42) BCL2L1BCL2NPC1RAB9A

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
EP-4279476-A1 METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-22 — — EP disclosed
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