SCHEMBL3759013

SCHEMBL3759013

Cc1c(-c2ccccc2)[c]ncc1N1CCCNCC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 11/20 0.53
HTR1A P08908 10/20 0.53
HTR2B P41595 10/20 0.53
HTR3A P46098 9/20 0.53
HTR6 P50406 8/20 0.53
NCF1 P14598 2/20 0.48
HTR1D P28221 6/20 0.47
HTR2A P28223 5/20 0.47
HTR2C P28335 1/20 0.47
HTR1B P28222 2/20 0.45
HTR5A P47898 1/20 0.43
ADRB1 P08588 3/20 0.42
ADRB2 P07550 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
PRKCI P41743 1/20 0.40

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
SCHEMBL3769533 0.95 HTR6 (0.49) HTR7HTR1AHTR2BHTR3AHTR6
SCHEMBL3751377 0.88 NPY5R (0.41) HTR7HTR1AHTR2BHTR3AHTR6
SCHEMBL3754790 0.87 NPY5R (0.43) NCF1
SCHEMBL3754803 0.79 NCF1 (0.44) NCF1
SCHEMBL3998045 0.76 ADRB1 (0.43) HTR7HTR1AHTR2BHTR3AHTR6
SCHEMBL3760252 0.74 HTR6 (0.51) HTR7HTR1AHTR2BHTR3AHTR6
SCHEMBL3756490 0.72 SIGMAR1 (0.47)
SCHEMBL3752036 0.71 HTR1A (0.41) HTR7HTR1AHTR2BHTR3AHTR6
SCHEMBL409069 0.69 ADRB1 (0.86) HTR7HTR1AHTR2BHTR3AHTR6
SCHEMBL3996914 0.68 SRD5A1 (0.38)

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 HTR7 2294/4885HTR1A 3013/4885HTR2B 2122/4885

“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.