SCHEMBL11820344

SCHEMBL11820344

Nc1cc2c3c(cccc3c1O)CC2

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.58
KDM4E B2RXH2 10/20 0.58
HPGD P15428 9/20 0.58
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
LMNA P02545 5/20 0.58
MAPT P10636 4/20 0.58
GAA P10253 3/20 0.58
POLB P06746 2/20 0.40
HSD17B10 Q99714 3/20 0.39
CYP3A4 P08684 2/20 0.39
ALOX15 P16050 1/20 0.39
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SCN2A Q99250 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ATM Q13315 1/20 0.38
HTT P42858 2/20 0.37

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
SCHEMBL15476908 0.81 KDM4E (0.47) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL9507593 0.81 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL4978820 0.74 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL6155960 0.74 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDMEN1KMT2A
Hydrochloric Acid SCHEMBL4707562 0.72 ALDH1A1 (0.96) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL31213424 0.71 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL31573100 0.70 HPGD (0.57) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL5376037 0.70 HPGD (0.57) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL24465892 0.68 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL29765599 0.67 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDMEN1KMT2A

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-3985763-A DYESTUFFS BAYER AKTIENGESELLSCHAFT (DT) 1976-10-12 US disclosed