SCHEMBL15070064

SCHEMBL15070064

Cc1ccc2c(c1)C(C)(C)c1cc(-c3ccc(-c4ccc(C(C)(C)C)cc4)s3)ccc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.38
▸ WRN Q14191 1/20 0.36
▸ FLT3 P36888 1/20 0.35
▸ PDK2 Q15119 3/20 0.34
▸ HSD17B1 P14061 2/20 0.34
▸ HSD17B2 P37059 2/20 0.34
▸ PRKDC P78527 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ PGR P06401 3/20 0.33
▸ PTAFR P25105 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TNF P01375 1/20 0.32
▸ NOD1 Q9Y239 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31

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
SCHEMBL15070053 0.90 PDK2 (0.39) PDK2HSD17B1HSD17B2PGRCYP3A4
SCHEMBL12744012 0.90 PDK2 (0.38) PDK2HSD17B1HSD17B2MAPTPGR
SCHEMBL15070055 0.88 PDK2 (0.38) PDK2HSD17B1HSD17B2PGRCYP3A4
SCHEMBL12744418 0.88 PDK2 (0.37) PDK2HSD17B1HSD17B2MAPTPGR
SCHEMBL12744014 0.88 PDK2 (0.37) PDK2HSD17B1HSD17B2MAPTPGR
SCHEMBL12440734 0.83 PGR (0.40) PDK2HSD17B1HSD17B2ALDH1A1MAPT
SCHEMBL10023966 0.82 PGR (0.41) PDK2KMT2AALDH1A1MAPTPGR
SCHEMBL15070066 0.82 WRN (0.35) WRNPDK2HSD17B1HSD17B2KMT2A
SCHEMBL22780261 0.80 TSHR (0.45) TSHRPDK2HSD17B2KMT2AALDH1A1
SCHEMBL12744097 0.80 PGR (0.48) PDK2HSD17B1HSD17B2PGR

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-8716703-B2 Organic semiconductor transistor FUJI XEROX CO., LTD. (JP) 2014-05-06 — — US disclosed
US-20130161589-A1 ORGANIC SEMICONDUCTOR TRANSISTOR FUJI XEROX CO., LTD. (JP) 2013-06-27 — — US disclosed
Send feedback