SCHEMBL11230693

SCHEMBL11230693

CC(C)N(Cc1ccccc1)C(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
ATM Q13315 2/20 0.50
PSEN1 P49768 1/20 0.50
PSEN2 P49810 1/20 0.50
APH1B Q8WW43 1/20 0.50
NCSTN Q92542 1/20 0.50
APH1A Q96BI3 1/20 0.50
PSENEN Q9NZ42 1/20 0.50
PPARG P37231 1/20 0.49
TMEM97 Q5BJF2 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
PARP1 P09874 1/20 0.47
LMNA P02545 2/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
WDR5 P61964 1/20 0.45
THRB P10828 1/20 0.45

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
SCHEMBL11226889 0.89 WDR5 (0.56) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL14427596 0.84 MEN1 (0.67) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL132642 0.84 MEN1 (0.58) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL11232783 0.82 MEN1 (0.56) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL11229863 0.80 ATM (0.68) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL10050569 0.79 PSEN1 (0.53) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL97454 0.78 MEN1 (0.58) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL11213394 0.77 PPARG (0.56) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL1701279 0.77 KMT2A (0.76) MEN1KMT2AATMPSEN1PSEN2
SCHEMBL7972682 0.76 KMT2A (0.69) MEN1KMT2AATMPSEN1PSEN2

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-4331815-A Process for manufacturing N-benzyl-N-isopropyl amides GULF OIL CORPORATION (US) 1982-05-25 US claimed
US-4331815-A Process for manufacturing N-benzyl-N-isopropyl amides GULF OIL CORPORATION (US) 1982-05-25 US disclosed
US-3974218-A N-BENZYL AMIDES OF ALKANOIC AND BENZOIC ACIDS GULF RESEARCH & DEVELOPMENT COMPANY (US) 1976-08-10 US disclosed