SCHEMBL11224899

SCHEMBL11224899

CCn1c(C)c(C(c2ccccc2)c2ccc(N(C)C)cc2)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
MAPT P10636 4/20 0.46
HTT P42858 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
KDM4E B2RXH2 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
RAB9A P51151 1/20 0.46
GFER P55789 1/20 0.46
CYP19A1 P11511 2/20 0.44
GAA P10253 2/20 0.43
LMNA P02545 2/20 0.38
MAPK1 P28482 2/20 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
SCHEMBL9657922 0.97 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL9656627 0.95 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL7454319 0.86 CYP19A1 (0.48) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL30587346 0.86 CYP19A1 (0.48) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL10729723 0.85 CYP19A1 (0.44) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL8777784 0.84 CYP19A1 (0.42) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL10724663 0.84 SRC (0.46) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL8777552 0.84 CYP19A1 (0.43) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL10725173 0.82 CYP19A1 (0.45) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL8777790 0.82 CYP19A1 (0.43) ALDH1A1MEN1KMT2AMAPTHTT

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-4403791-A Carbonless duplicating and marking systems STERLING DRUG INC. (US) 1983-09-13 US claimed