SCHEMBL3760075

SCHEMBL3760075

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

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.42
NPC1 O15118 7/20 0.39
RAB9A P51151 7/20 0.39
CHRNA7 P36544 2/20 0.39
PIK3CA P42336 2/20 0.37
PIK3R1 P27986 1/20 0.37
BUB1 O43683 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PIK3CD O00329 1/20 0.37
PIK3CB P42338 1/20 0.37
PIK3CG P48736 1/20 0.37
BRD4 O60885 3/20 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
SCHEMBL3763361 0.93 PRKDC (0.42) PRKDCNPC1RAB9ACHRNA7PIK3CA
SCHEMBL3763545 0.91 RAB9A (0.46) PRKDCNPC1RAB9ACHRNA7PIK3CA
SCHEMBL3765924 0.91 PIK3CA (0.44) PRKDCNPC1RAB9ACHRNA7PIK3CA
SCHEMBL3766528 0.91 PRKDC (0.52) PRKDCNPC1RAB9ACHRNA7PIK3CA
SCHEMBL16161718 0.90 PRKDC (0.40) PRKDCNPC1RAB9ACHRNA7PIK3CA
SCHEMBL3759350 0.90 NPC1 (0.51) NPC1RAB9ACHRNA7PIK3CA
SCHEMBL3751898 0.90 NPC1 (0.46) PRKDCNPC1RAB9AHSD17B10
SCHEMBL3759355 0.89 PRKDC (0.41) PRKDCNPC1RAB9ABUB1BRD4
SCHEMBL16161666 0.88 POLB (0.42) PRKDCNPC1RAB9ACHRNA7HSD17B10
SCHEMBL3758789 0.88 SMN1; SMN2 (0.46) PRKDCNPC1RAB9APIK3CDPIK3CB

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 PRKDC 112/4885NPC1 3855/4885RAB9A 713/4885

“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.