SCHEMBL6538527

SCHEMBL6538527

CC(C)n1nc(-c2ccc(=O)[nH]c2-c2ccc(F)cc2)ccc1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 7/20 0.40
HTR2B P41595 2/20 0.40
BRD4 O60885 1/20 0.38
HDAC6 Q9UBN7 1/20 0.35
BMPR1B O00238 1/20 0.35
BMPR1A P36894 1/20 0.35
TGFBR1 P36897 1/20 0.35
ACVRL1 P37023 1/20 0.35
ACVR1 Q04771 1/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR7 P34969 1/20 0.34
HRH3 Q9Y5N1 2/20 0.34
MAPK14 Q16539 3/20 0.34
PGR P06401 1/20 0.34
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
GCGR P47871 1/20 0.33

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
SCHEMBL6538758 0.88 PDE10A (0.38) PDE10ABMPR1BBMPR1ATGFBR1ACVRL1
SCHEMBL6539121 0.86 PDE10A (0.45) PDE10AHTR2BHTR2AHTR2CHRH3
SCHEMBL11403155 0.79 CA1 (0.45) HTR2BHDAC6BMPR1BBMPR1ATGFBR1
SCHEMBL6538769 0.78 PDE1A (0.39)
SCHEMBL6539134 0.78 BRD4 (0.39) PDE10ABRD4
SCHEMBL6538958 0.77 HCAR1 (0.32) PDE10ABMPR1BBMPR1ATGFBR1ACVRL1
SCHEMBL6538398 0.75 ADORA2A (0.50) PDE10AHDAC6BMPR1BBMPR1ATGFBR1
SCHEMBL6134450 0.71 ADORA1 (0.50) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL6539040 0.70 PDE10A (0.40) PDE10ABRD4HRH3
SCHEMBL6538511 0.70 PDE1A (0.38) PDE10ABRD4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-04-08 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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof ADORA1, ADORA2A, P2RX5 PDE10A 132/4885HTR2B 102/4885BRD4 2305/4885

“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.