SCHEMBL20062963

SCHEMBL20062963

CC(C)(C)c1ccc2c(c1)N(c1ccc(C(C)(C)C)s1)/C(=C1\N(c3ccc(C(C)(C)C)s3)c3ccc(C(C)(C)C)cc3N1c1ccc(C(C)(C)C)s1)N2c1ccc(C(C)(C)C)s1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL20062961 0.82 MAPK1 (0.33) MAPK1KMT2A
SCHEMBL20071773 0.81 MAPT (0.34) MAPTSMN1; SMN2ALDH1A1HPGDALOX15
SCHEMBL20062960 0.79 AR (0.38) ALDH1A1HPGDMAPK1
SCHEMBL18905684 0.73 CA9 (0.39) MAPTSMN1; SMN2ALDH1A1HPGDALOX15
SCHEMBL18905679 0.73 CA9 (0.39) MAPTSMN1; SMN2ALDH1A1HPGDALOX15
SCHEMBL18905704 0.71 ALDH1A1 (0.35) MAPTSMN1; SMN2ALDH1A1HPGDALOX15
SCHEMBL18905685 0.70 KCNH2 (0.36) MAPTSMN1; SMN2ALDH1A1HPGDALOX15
SCHEMBL18905689 0.70 TSHR (0.38) MAPTALDH1A1HPGDALOX15HSD17B10
SCHEMBL18905680 0.70 TSHR (0.38) MAPTALDH1A1HPGDALOX15HSD17B10
SCHEMBL18905694 0.69 NOTUM (0.39) ALDH1A1HPGDALOX15HSD17B10TDP1

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-20180108691-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, OPTICAL AREA SENSOR, IMAGING DEVICE, AND IMAGING APPARATUS CANON KABUSHIKI KAISHA (JP) 2018-04-19 US disclosed