SCHEMBL3754887

SCHEMBL3754887

CC1(C)CC(=O)c2sc(N3CCOCC3)c(-c3cc4ccccc4o3)c2C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 4/20 0.47
ATM Q13315 1/20 0.47
NPC1 O15118 5/20 0.43
MAPT P10636 4/20 0.43
RAB9A P51151 4/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
KDM4E B2RXH2 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
PIK3CA P42336 6/20 0.43
PIK3CD O00329 5/20 0.43
PIK3CG P48736 5/20 0.43
PIK3CB P42338 4/20 0.43
BRD4 O60885 1/20 0.41
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
LMNA P02545 2/20 0.37
TP53 P04637 2/20 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
SCHEMBL3756134 0.87 NPC1 (0.45) PRKDCATMNPC1MAPTRAB9A
SCHEMBL16161711 0.81 PRKDC (0.47) PRKDCMAPTALDH1A1PIK3CAPIK3CD
SCHEMBL3760389 0.80 BRD4 (0.46) PRKDCALDH1A1KDM4EPIK3CAPIK3CD
SCHEMBL3759076 0.79 PIK3CD (0.41) PRKDCNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3758948 0.79 PIK3CD (0.42) PRKDCALDH1A1KDM4EPIK3CAPIK3CD
SCHEMBL3759838 0.78 PRKDC (0.48) PRKDCATMALDH1A1SMN1; SMN2KDM4E
SCHEMBL3757704 0.77 PIK3CD (0.42) PRKDCPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL3759992 0.77 BRD4 (0.47) PRKDCNPC1MAPTRAB9AALDH1A1
SCHEMBL3760142 0.77 PIK3CA (0.45) PRKDCNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3764864 0.76 PIK3CA (0.42) PRKDCALDH1A1KDM4EPIK3CAPIK3CD

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 5 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
EP-2029570-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-04 EP disclosed
WO-2007141504-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2007-12-13 WO 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 112/4885ATM 396/4885NPC1 3855/4885

“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.