SCHEMBL3765589

SCHEMBL3765589

CC1(C)CC(=O)c2sc(N3CCOCC3)c(-c3cccc(NC(=O)N4CCC(NC(=O)O)C4)c3)c2C1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.38
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CHRNA7 P36544 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GAK O14976 1/20 0.34
POLB P06746 1/20 0.34
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
RAF1 P04049 1/20 0.33
CASP3 P42574 1/20 0.33
CASP7 P55210 1/20 0.33

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
SCHEMBL3769608 0.90 PRKDC (0.40) PRKDCNPC1RAB9ACHRNA7ALDH1A1
SCHEMBL3759018 0.89 ROCK1 (0.40) PRKDCNPC1RAB9AALDH1A1GAK
SCHEMBL3751898 0.88 NPC1 (0.46) PRKDCNPC1RAB9AKMT2AALDH1A1
SCHEMBL3763755 0.86 ALDH1A1 (0.34) KMT2ACHRNA7ALDH1A1LMNA
SCHEMBL16161666 0.86 POLB (0.42) PRKDCNPC1RAB9AKMT2ACHRNA7
SCHEMBL3757637 0.85 KDM4E (0.48) PRKDCNPC1RAB9AKMT2AALDH1A1
SCHEMBL3766528 0.84 PRKDC (0.52) PRKDCNPC1RAB9AKMT2ACHRNA7
SCHEMBL3751903 0.84 NPC1 (0.41) PRKDCNPC1RAB9AALDH1A1GAK
SCHEMBL16161821 0.84 GAA (0.46) PRKDCNPC1RAB9AKMT2AALDH1A1
SCHEMBL3760240 0.84 PTPN1 (0.44) PRKDCKMT2AALDH1A1POLB

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.