SCHEMBL3765033

SCHEMBL3765033

O=C(Nc1[c]cccc1)NN1CCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
CDK5 Q00535 6/20 0.37
CDK5R1 Q15078 6/20 0.37
CCNA2 P20248 5/20 0.37
CDK2 P24941 5/20 0.37
CCNA1 P78396 5/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 2/20 0.36
PIK3CA P42336 1/20 0.36
MTOR P42345 1/20 0.36
PIK3CG P48736 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
GLA P06280 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL9725165 0.79 SMN1; SMN2 (0.44) HTTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL3765648 0.76 SMN1; SMN2 (0.36) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL3765882 0.74 TSHR (0.49) NPC1RAB9ASMN1; SMN2POLBKMT2A
SCHEMBL3759129 0.73 TSHR (0.51) NPC1RAB9ASMN1; SMN2POLBKMT2A
SCHEMBL3996276 0.73 SMN1; SMN2 (0.53) NPC1RAB9ASMN1; SMN2POLBKMT2A
SCHEMBL3765035 0.72 NPC1 (0.46) HTTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL8669623 0.72 HSD17B10 (0.50) NPC1RAB9ASMN1; SMN2LMNAPOLB
SCHEMBL3760383 0.72 KMT2A (0.59) HTTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL3765649 0.72 ATM (0.32) HTT
SCHEMBL3754787 0.71 SMN1; SMN2 (0.63) HTTNPC1RAB9ASMN1; SMN2LMNA

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 7 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-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 HTT 1234/4885CDK5 175/4885CDK5R1 539/4885

“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.