SCHEMBL11071245

SCHEMBL11071245

CCn1c(C)c(C2(N(c3ccccc3)c3ccc(N(C)C)cc3)OC(=O)c3ccccc32)c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
CYP3A4 P08684 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CYP1A2 P05177 3/20 0.35
CYP2C19 P33261 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP2C9 P11712 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
NPC1 O15118 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
GFER P55789 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
BLM P54132 1/20 0.35
LYN P07948 1/20 0.33
SRC P12931 1/20 0.33

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
SCHEMBL11063319 0.98 ALDH1A1 (0.36) ALDH1A1CYP3A4MEN1KMT2ACYP1A2
SCHEMBL3877954 0.95 ALDH1A1 (0.38) ALDH1A1CYP3A4MEN1KMT2ACYP1A2
SCHEMBL11362904 0.91 LYN (0.35) ALDH1A1CYP3A4MEN1KMT2ACYP1A2
SCHEMBL11061257 0.89 LMNA (0.38) ALDH1A1CYP3A4MEN1KMT2ACYP1A2
SCHEMBL3873669 0.89 SMN1; SMN2 (0.41) ALDH1A1CYP3A4CYP2C19KDM4EMAPT
SCHEMBL11232126 0.87 KDM4E (0.37) ALDH1A1CYP3A4MEN1KMT2ACYP1A2
SCHEMBL11058518 0.86 NPSR1 (0.43) MEN1KMT2AKDM4EMAPTHPGD
SCHEMBL11065740 0.85 ALDH1A1 (0.41) ALDH1A1CYP2C19KDM4EHPGDCYP2C9
SCHEMBL11245671 0.85 ALDH1A1 (0.38) ALDH1A1CYP3A4MEN1KMT2ACYP1A2
SCHEMBL11063409 0.84 RORA (0.38) ALDH1A1MEN1KMT2ACYP2C19KDM4E

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-4431819-A PRESSURE AND HEAT SENSITIVE ELEMENTS; CARBONLESS COPYING; HECTOGRAPHY; XERORAPHY STERLING DRUG INC. (US) 1984-02-14 US disclosed
US-4251092-A COATED WITH A 3-HETERO-3-(DIPHENYLAMINO)PHTHALIDES COLOR FORMER STERLING DRUG INC. (US) 1981-02-17 US disclosed
US-4182714-A CARBONLESS COLORING DUPLICATING STERLING DRUG INC. (US) 1980-01-08 US disclosed