SCHEMBL3759936

SCHEMBL3759936

CC1(C)CC(=O)c2sc(N3CCOCC3)c(-c3cccc(C(=O)NCCN4CCOCC4)c3)c2C1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.49
CYP2C9 P11712 1/20 0.49
ERN1 O75460 1/20 0.48
CD274 Q9NZQ7 2/20 0.46
HPGD P15428 1/20 0.46
POLB P06746 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
EPHX2 P34913 3/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAP4K4 O95819 1/20 0.44
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
CAMK2D Q13557 1/20 0.43
ABL1 P00519 1/20 0.43

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
SCHEMBL3765560 0.90 BUB1 (0.40) CYP2C19CYP2C9ERN1SMN1; SMN2
SCHEMBL3759012 0.88 JAK2 (0.47) CYP2C19CYP2C9CAMK2D
SCHEMBL3757673 0.87 PIK3CA (0.41)
SCHEMBL3765955 0.87 DYRK1A (0.48) SMN1; SMN2EPHX2
SCHEMBL3764646 0.87 MAPK1 (0.47) EPHX2
SCHEMBL3761437 0.86 PRMT5 (0.41) SMN1; SMN2
SCHEMBL3763752 0.85 KDM1A (0.39) POLB
SCHEMBL3762516 0.85 MEN1 (0.46)
SCHEMBL3759832 0.85 PRKDC (0.39) ERN1
SCHEMBL3754752 0.84 PRKDC (0.45) POLBSMN1; 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 CYP2C19 1473/4885CYP2C9 1620/4885ERN1 1095/4885

“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.