SCHEMBL11823392

SCHEMBL11823392

Cc1[nH]c2cc(F)ccc2c1CCC(=O)N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ ALDH1A1 P00352 3/20 0.49
▸ TACR1 P25103 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ ALOX5 P09917 1/20 0.46
▸ LMNA P02545 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ HTR7 P34969 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ PTGDR2 Q9Y5Y4 1/20 0.44
▸ MC4R P32245 1/20 0.44

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
SCHEMBL11819506 0.92 KMT2A (0.56) KMT2AMEN1ALDH1A1TACR1L3MBTL1
SCHEMBL11834769 0.91 MEN1 (0.50) KMT2AMEN1TACR1L3MBTL1TSHR
SCHEMBL11829997 0.89 PKM (0.48) KMT2AALDH1A1TACR1L3MBTL1LMNA
SCHEMBL11828042 0.86 GFER (0.55) KMT2AMEN1TACR1LMNAGFER
SCHEMBL11822913 0.83 SIGMAR1 (0.47) ALDH1A1LMNA
SCHEMBL11834886 0.82 GFER (0.54) KMT2AMEN1ALDH1A1TACR1LMNA
SCHEMBL11830955 0.81 POLB (0.46) KMT2AALDH1A1TACR1L3MBTL1TSHR
SCHEMBL11822960 0.80 TACR1 (0.69) KMT2AMEN1TACR1L3MBTL1LMNA
SCHEMBL11823402 0.78 ALDH1A1 (0.47) KMT2AMEN1ALDH1A1SMN1; SMN2CYP2D6
SCHEMBL11826994 0.78 TACR1 (0.61) KMT2AMEN1TACR1LMNAGFER

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-3933824-A Piperazinobutyrophenone derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-01-20 — — US disclosed
Send feedback