SCHEMBL9470338

SCHEMBL9470338

OCCCCCCN1CCc2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.68
MEN1 O00255 5/20 0.68
KMT2A Q03164 5/20 0.68
USP2 O75604 1/20 0.68
CDK4 P11802 1/20 0.68
ALOX15 P16050 1/20 0.68
CCND1 P24385 1/20 0.68
MAPT P10636 4/20 0.58
KDM4E B2RXH2 2/20 0.58
POLB P06746 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
LMNA P02545 2/20 0.55
PTK2B Q14289 1/20 0.55
ESR2 Q92731 1/20 0.55
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
ALOX5 P09917 1/20 0.45
EPHX2 P34913 1/20 0.45
CHRM2 P08172 7/20 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
SCHEMBL7068245 0.93 ALDH1A1 (0.72) ALDH1A1MEN1KMT2AUSP2CDK4
Hydrochloric Acid SCHEMBL19149285 0.92 ALDH1A1 (0.70) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL10995953 0.90 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL9480671 0.90 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL3131072 0.86 ALDH1A1 (0.78) ALDH1A1MEN1KMT2AUSP2CDK4
Hydrochloric Acid SCHEMBL25366634 0.84 ALDH1A1 (0.75) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL25227934 0.83 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL19746738 0.83 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL25229724 0.83 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL15921493 0.83 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AUSP2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5186865-A Aminoazobenzene derivatives and polymers ALLIED-SIGNAL INC. (US) 1993-02-16 US disclosed
US-5061404-A WAVEGUIDES ALLIED-SIGNAL INC. (US) 1991-10-29 US disclosed