SCHEMBL10852238

SCHEMBL10852238

CN1CC[C@](O)(c2ccc(Cl)cc2)[C@@H](c2ccccc2F)C1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ MEN1 O00255 1/20 0.46
▸ SLC6A3 Q01959 6/20 0.44
▸ DRD2 P14416 2/20 0.39
▸ CCR1 P32246 1/20 0.39
▸ HSD11B1 P28845 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ OPRL1 P41146 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
SCHEMBL10655981 1.00 KMT2A (0.53) KMT2AALDH1A1MAPTLMNAMEN1
SCHEMBL10655986 1.00 KMT2A (0.53) KMT2AALDH1A1MAPTLMNAMEN1
Maleic Acid SCHEMBL10852680 0.91 KMT2A (0.51) KMT2AALDH1A1MAPTLMNAMEN1
SCHEMBL10855621 0.90 KMT2A (0.55) KMT2AALDH1A1MAPTLMNASLC6A3
SCHEMBL10654641 0.90 KMT2A (0.55) KMT2AALDH1A1MAPTLMNASLC6A3
SCHEMBL10654646 0.90 KMT2A (0.55) KMT2AALDH1A1MAPTLMNASLC6A3
SCHEMBL10850072 0.90 KMT2A (0.53) KMT2AALDH1A1MAPTLMNASLC6A3
SCHEMBL10650651 0.90 KMT2A (0.53) KMT2AALDH1A1MAPTLMNASLC6A3
SCHEMBL10851687 0.90 KMT2A (0.53) KMT2AALDH1A1MAPTLMNASLC6A3
SCHEMBL10655668 0.89 SLC6A3 (0.55) KMT2AALDH1A1MAPTLMNASLC6A3

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
US-4585779-A cis-4a-Aryl-1,2,3,4,4a,9b-hexahydro-benzofuro[3,2-c]pyridines and intermediates thereof HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1986-04-29 — — US claimed
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