SCHEMBL20071949

SCHEMBL20071949

CC(C)(C)c1ccc(-c2ccc3c(c2)N(c2ccc(C(C)(C)C)cc2)C(C2N(c4ccc(C(C)(C)C)cc4)c4ccc(-c5ccc(C(C)(C)C)cc5)cc4N2c2ccc(C(C)(C)C)cc2)N3c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.41
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
PTGES O14684 1/20 0.33
PDPK1 O15530 1/20 0.33
HTR1D P28221 1/20 0.33
ADRA1A P35348 1/20 0.33
NISCH Q9Y2I1 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
XDH P47989 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 1/20 0.32
DHODH Q02127 1/20 0.32

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
SCHEMBL18911711 0.82 TSHR (0.48) CA12CA9MAPTSMN1; SMN2ALDH1A1
SCHEMBL18911906 0.80 CYP2C9 (0.33) MAPTSMN1; SMN2ALDH1A1HPGDALOX15
SCHEMBL18911905 0.78 CYP2C9 (0.37) MAPTSMN1; SMN2ALDH1A1HPGDALOX15
SCHEMBL18911896 0.77 ADRB1 (0.36) ALDH1A1HPGDTDP1TSHR
SCHEMBL18911900 0.77 NR1I2 (0.33) ALDH1A1TSHRNR1H4
SCHEMBL20681889 0.77 KIF11 (0.43) KIF11MAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL20071978 0.77 TSHR (0.50) RXRACA9MAPTSMN1; SMN2ALDH1A1
SCHEMBL18911784 0.75 HTR1A (0.40) MAPTALDH1A1HPGDALOX15HSD17B10
SCHEMBL18911902 0.75 CYP3A4 (0.31)
SCHEMBL18905690 0.75 KIF11 (0.40) KIF11CA12CA9PTGESPDPK1

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-10541260-B2 Organic photoelectric conversion element, optical area sensor, imaging device, and imaging apparatus CANON KABUSHIKI KAISHA (JP) 2020-01-21 US disclosed
US-20180108691-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, OPTICAL AREA SENSOR, IMAGING DEVICE, AND IMAGING APPARATUS CANON KABUSHIKI KAISHA (JP) 2018-04-19 US disclosed