SCHEMBL3756222

SCHEMBL3756222

CCS(=O)(=O)Nc1cccc(-c2c(N3CCOCC3)sc3c2CC(C)(C)CC3=O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.44
TP53 P04637 3/20 0.40
KMT2A Q03164 1/20 0.38
LMNA P02545 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
USP2 O75604 1/20 0.38
MAPK1 P28482 1/20 0.38
HIF1A Q16665 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
THRB P10828 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
MAPT P10636 2/20 0.37
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
PIK3CG P48736 1/20 0.37
BRDT Q58F21 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL3761701 0.91 TP53 (0.46) BRD4TP53LMNACYP1A2CYP3A4
SCHEMBL3760624 0.88 THRB (0.45) BRD4TP53LMNACYP1A2CYP3A4
SCHEMBL3759355 0.86 PRKDC (0.41) BRD4KMT2ACYP3A4NPC1RAB9A
SCHEMBL3766528 0.85 PRKDC (0.52) KMT2ANPC1RAB9AMAPTPIK3CD
SCHEMBL3769346 0.84 MTOR (0.43) BRD4PIK3CDPIK3CAPIK3CG
SCHEMBL16161718 0.84 PRKDC (0.40) BRD4NPC1RAB9APIK3CDPIK3CA
SCHEMBL3760075 0.83 PRKDC (0.42) BRD4NPC1RAB9APIK3CDPIK3CA
SCHEMBL3765924 0.83 PIK3CA (0.44) BRD4KMT2ANPC1RAB9AMAPT
SCHEMBL3763361 0.83 PRKDC (0.42) BRD4NPC1RAB9APIK3CDPIK3CA
SCHEMBL3751898 0.83 NPC1 (0.46) KMT2ALMNAMAPK1NPC1RAB9A

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 BRD4 1041/4885TP53 895/4885KMT2A 2175/4885

“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.