SCHEMBL3759350

SCHEMBL3759350

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

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.51
RAB9A P51151 9/20 0.51
CHRNA7 P36544 2/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
RAF1 P04049 2/20 0.42
BRAF P15056 2/20 0.42
BTK Q06187 2/20 0.42
CNR1 P21554 1/20 0.42
RPS6KA2 Q15349 1/20 0.42
RGS12 O14924 1/20 0.41
PABPC1 P11940 1/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
PIK3CA P42336 1/20 0.41

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
SCHEMBL3761532 0.93 PIK3CA (0.50) NPC1RAB9AALDH1A1SMN1; SMN2BTK
SCHEMBL3765924 0.91 PIK3CA (0.44) NPC1RAB9ACHRNA7ALDH1A1PIK3CA
SCHEMBL3760075 0.90 PRKDC (0.42) NPC1RAB9ACHRNA7PIK3CA
SCHEMBL3766528 0.90 PRKDC (0.52) NPC1RAB9ACHRNA7ALDH1A1BRAF
SCHEMBL3763361 0.88 PRKDC (0.42) NPC1RAB9ACHRNA7BTKPIK3CA
SCHEMBL3751898 0.88 NPC1 (0.46) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3758789 0.88 SMN1; SMN2 (0.46) NPC1RAB9AALDH1A1SMN1; SMN2BTK
SCHEMBL3759355 0.87 PRKDC (0.41) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3755814 0.87 NPC1 (0.41) NPC1RAB9ACHRNA7ALDH1A1SMN1; SMN2
SCHEMBL16161666 0.87 POLB (0.42) NPC1RAB9ACHRNA7ALDH1A1SMN1; SMN2

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 3855/4885RAB9A 713/4885CHRNA7 4644/4885

“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.