SCHEMBL4052940

SCHEMBL4052940

Cc1cc(Cl)c2c(ccn2C(=O)O)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TFPI2 P48307 1/20 0.35
HRH4 Q9H3N8 2/20 0.34
RAPGEF4 Q8WZA2 1/20 0.34
OXER1 Q8TDS5 2/20 0.33
FABP4 P15090 2/20 0.33
HTT P42858 2/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
NOTUM Q6P988 4/20 0.33
ALDH1A1 P00352 1/20 0.33
GPR35 Q9HC97 1/20 0.33
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
SLC22A12 Q96S37 1/20 0.32

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
SCHEMBL27812709 0.85 ACLY (0.36) OXER1FABP4RAB9AGPR35SLC22A12
SCHEMBL4048832 0.82 RAPGEF4 (0.38) TFPI2RAPGEF4FABP4HTTRAB9A
SCHEMBL31357921 0.81 TUBB1 (0.39) TFPI2FABP4MEN1KMT2AALDH1A1
SCHEMBL4053601 0.79 MYC (0.41) TFPI2RAPGEF4HTTRAB9AKMT2A
SCHEMBL12422252 0.79 HSP90AA1 (0.43) HTTMEN1KMT2A
SCHEMBL4048010 0.78 OXER1 (0.38) HRH4OXER1FABP4HTTNOTUM
SCHEMBL4046944 0.78 CCR2 (0.34) OXER1
SCHEMBL4046697 0.76 TFPI2 (0.33) TFPI2OXER1NOTUMALDH1A1KDM4E
SCHEMBL15971447 0.75 NOTUM (0.41) OXER1MEN1RAB9AKMT2ANOTUM
SCHEMBL23360825 0.73 NOTUM (0.41) NOTUMALDH1A1KDM4ESLC22A12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025068951-A1 COMPLEMENT FACTOR B INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2025-04-03 WO disclosed
US-7589097-B2 Triazol[4,5-d] pyramidine derivatives and their use as purinergic receptor antagonists VERNALIS RESEARCH LIMITED (GB) 2009-09-15 US disclosed
EP-1392312-B1 TRIAZOLO 4,5-d PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS VERNALIS RES LTD (GB) 2009-03-04 EP disclosed
US-20080234296-A1 Triazolo[4,5-d] pyramidine derivatives and their use as purinergic receptor antagonists VERNALIS RESEARCH LIMITED 2008-09-25 US disclosed
US-7405219-B2 Triazolo [4,5-d] pyrimidine derivatives and their use as purinergic receptor antagonists VERNALIS RESEARCH LIMITED (GB) 2008-07-29 US disclosed
US-20070049607-A1 Triazolo [4,5-d] pyrimidine derivatives and their use as purinergic receptor antagonists VERNALIS RESEARCH LIMITED 2007-03-01 US disclosed
US-7141575-B2 Triazolo[4,5-d]pyrimidine derivatives and their use as purinergic receptor antagonists VERNALIS RESEARCH LTD. (GB) 2006-11-28 US disclosed
US-20040097526-A1 Triazolo[4,5-d]pyrimidine derivatives and their use as purinergic receptor antagonists VERNALIS DEVELOPMENT LIMITED (GB) 2004-05-20 US disclosed
EP-1392312-A1 TRIAZOLO 4,5-d] PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS VERNALIS RESEARCH LIMITED (GB) 2004-03-03 EP disclosed
WO-2002055083-A1 TRIAZOLO[4,5-d] PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS VERNALIS RESEARCH LIMITED (GB) 2002-07-18 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 (3 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-20080234296-A1 Triazolo[4,5-d] pyramidine derivatives and their use as purinergic receptor antagonists CHRNA5, ADORA2A, CHRNA4 TFPI2 4491/4885HRH4 135/4885RAPGEF4 950/4885
US-20070049607-A1 Triazolo [4,5-d] pyrimidine derivatives and their use as purinergic receptor antagonists CHRNA5, ADORA2A, CHRNA4 TFPI2 4456/4885HRH4 129/4885RAPGEF4 1255/4885
US-20040097526-A1 Triazolo[4,5-d]pyrimidine derivatives and their use as purinergic receptor antagonists CHRNA5, CHRNA4, CNR1 TFPI2 4268/4885HRH4 181/4885RAPGEF4 990/4885

“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.