SCHEMBL11450504

SCHEMBL11450504

COC1CCCC1N(C(=O)CCCl)c1ccc(C)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ MITF O75030 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ OPRM1 P35372 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ YAP1 P46937 1/20 0.31
▸ TEAD4 Q15561 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 1/20 0.31

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
SCHEMBL11436721 0.90 ALDH1A1 (0.36) ALDH1A1KDM4ERAB9AMEN1KMT2A
SCHEMBL11438327 0.89 MEN1 (0.39) ALDH1A1KDM4ERAB9AMEN1KMT2A
SCHEMBL11446547 0.84 NPC1 (0.38) ALDH1A1KDM4ERAB9AMEN1KMT2A
SCHEMBL11436730 0.84 ALDH1A1 (0.38) ALDH1A1KDM4ERAB9AMEN1KMT2A
SCHEMBL11437911 0.82 RAB9A (0.37) ALDH1A1RAB9AKMT2ANPC1L3MBTL1
SCHEMBL11465500 0.82 KMT2A (0.37) ALDH1A1KDM4ERAB9AMEN1KMT2A
SCHEMBL11341133 0.80 RAB9A (0.40) ALDH1A1KDM4ERAB9AMEN1KMT2A
SCHEMBL11450497 0.80 MAPK1 (0.40) ALDH1A1KDM4ERAB9AMEN1KMT2A
SCHEMBL11550476 0.79 RAB9A (0.39) ALDH1A1KDM4ERAB9AMEN1KMT2A
SCHEMBL11437571 0.79 ALDH1A1 (0.37) ALDH1A1KDM4ERAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4217362-A Anilide derivatives as antidepressants THE UPJOHN COMPANY (US) 1980-08-12 — — US disclosed
US-4212888-A Anilide derivatives as antidepressants THE UPJOHN COMPANY (US) 1980-07-15 — — US disclosed
US-4128663-A Anilide derivatives as antidepressants THE UPJOHN COMPANY (US) 1978-12-05 — — US disclosed
Send feedback