SCHEMBL3759112

SCHEMBL3759112

O=C(Nc1[c]cccc1)N1CCCC1c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.52
HSD11B1 P28845 2/20 0.52
RIPK1 Q13546 1/20 0.51
POLB P06746 1/20 0.47
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SCD5 Q86SK9 3/20 0.43
SCD O00767 2/20 0.43
CCNC P24863 1/20 0.42
CDK8 P49336 1/20 0.42
PPID Q08752 1/20 0.42
P2RX7 Q99572 1/20 0.41
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 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
SCHEMBL3765354 0.83 NPC1 (0.44) HSD11B1POLBTDP1NPC1RAB9A
SCHEMBL3765394 0.82 SMN1; SMN2 (0.43) POLBNPC1RAB9ASMN1; SMN2
SCHEMBL3769515 0.76 LHCGR (0.41) POLB
SCHEMBL1847627 0.74 RIPK1 (0.69) EPHX2HSD11B1RIPK1HSP90AA1HSP90AB1
SCHEMBL1853141 0.74 RIPK1 (0.69) EPHX2HSD11B1RIPK1HSP90AA1HSP90AB1
SCHEMBL17558248 0.74 RIPK1 (0.69) EPHX2HSD11B1RIPK1HSP90AA1HSP90AB1
SCHEMBL3763746 0.73 FKBP1A (0.46) NPC1
SCHEMBL3765882 0.73 TSHR (0.49) POLBNPC1RAB9ASMN1; SMN2
SCHEMBL12503522 0.73 EPHX2 (0.56) EPHX2HSD11B1RIPK1POLBHSP90AA1
SCHEMBL3062584 0.73 RIPK1 (0.67) EPHX2HSD11B1RIPK1HSP90AA1HSP90AB1

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 8 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
WO-2009122148-A1 FUSED THIOPHENE AND THIAZOLE DERIVATIVES AS PI3K KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-10-08 WO disclosed
WO-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071890-A1 TRICYCLIC KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO 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 EPHX2 3371/4885HSD11B1 3624/4885RIPK1 266/4885

“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.