SCHEMBL3755814

SCHEMBL3755814

CC1(C)CC(=O)c2sc(N3CCOCC3)c(-c3cccc(C(=O)c4ccccc4)c3)c2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 2/20 0.41
RAB9A P51151 2/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 3/20 0.40
ALOX5 P09917 1/20 0.40
POLB P06746 1/20 0.40
BRD4 O60885 1/20 0.39
PIK3CA P42336 2/20 0.39
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
PRKDC P78527 4/20 0.38
SCN9A Q15858 1/20 0.38
AKT1 P31749 1/20 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
SCHEMBL3754752 0.93 PRKDC (0.45) NPC1SMN1; SMN2RAB9AHSD17B10ALDH1A1
SCHEMBL3760529 0.91 PRKDC (0.47) NPC1RAB9ATP53ALOX15HSD17B10
SCHEMBL3763780 0.90 STK4 (0.43) HSD17B10BRD4PIK3CAPIK3CDPIK3CB
SCHEMBL3762573 0.89 HPGD (0.46) HPGDRAB9ATSHRHSD17B10PIK3CA
SCHEMBL3758948 0.88 PIK3CD (0.42) HPGDMAPK1HSD17B10ALDH1A1BRD4
SCHEMBL3757673 0.88 PIK3CA (0.41) NPC1RAB9AHSD17B10BRD4PIK3CA
SCHEMBL3765101 0.88 PIK3CA (0.38) SMN1; SMN2TP53ALOX15TSHRMAPK1
SCHEMBL3760325 0.87 PRKDC (0.49) HPGDALOX15HSD17B10ALDH1A1POLB
SCHEMBL3759350 0.87 NPC1 (0.51) NPC1SMN1; SMN2RAB9AALDH1A1PIK3CA
SCHEMBL3764646 0.86 MAPK1 (0.47) ALOX15MAPK1HSD17B10ALDH1A1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029570-B1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2014-10-15 EP disclosed
US-8324204-B2 Fused thiophene derivatives as kinase inhibitors UCB PHARMA SA (BE) 2012-12-04 US disclosed
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-12-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors PIKFYVE, PI4KA, PIK3CA NPC1 3855/4885SMN1; SMN2 1864/4885HPGD 3366/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.