SCHEMBL4437601

SCHEMBL4437601

O=C(O)c1ccc(C(c2cccc(Cl)c2)c2cccc(Cl)c2)s1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
C3AR1 Q16581 2/20 0.54
DAO P14920 2/20 0.47
ADRB3 P13945 3/20 0.46
ADRB1 P08588 2/20 0.46
ACP3 P15309 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
RORC P51449 1/20 0.39
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
HPGDS O60760 1/20 0.38

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
SCHEMBL4432455 0.82 DAO (0.58) C3AR1DAOMEN1KMT2AALDH1A1
SCHEMBL4439617 0.82 DAO (0.51) C3AR1DAOMEN1KMT2APOLB
SCHEMBL4430958 0.81 DAO (0.53) C3AR1DAOALDH1A1HPGDMRGPRX4
SCHEMBL4429427 0.80 C3AR1 (0.48) C3AR1MEN1KMT2AALDH1A1HPGD
SCHEMBL4437624 0.78 DAO (0.47) DAOACP3MEN1KMT2AALDH1A1
SCHEMBL4430935 0.75 C3AR1 (0.77) C3AR1
SCHEMBL4433275 0.72 DAO (0.59) C3AR1DAO
SCHEMBL4432196 0.72 DAO (0.50) DAOACP3MEN1KMT2AALDH1A1
SCHEMBL4438845 0.71 DAO (0.53) C3AR1DAOALDH1A1HPGD
SCHEMBL3754699 0.70 HPGDS (0.69) C3AR1ADRB3ADRB1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125739-A1 MODULATORS OF C3A RECEPTOR AND METHODS OF USE THEREOF ENCYSIVE PHARMACEUTICALS, INC. (US) 2009-12-02 EP disclosed
US-20080188528-A1 Modulators of C3a receptor and methods of use thereof ENCYSIVE PHARMACEUTICALS, INC. 2008-08-07 US disclosed
WO-2008079371-A1 MODULATORS OF C3A RECEPTOR AND METHODS OF USE THEREOF ENCYSIVE PHARMACEUTICALS, INC. (US) 2008-07-03 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-20080188528-A1 Modulators of C3a receptor and methods of use thereof C3AR1, C5, C5AR1 C3AR1 1/4885DAO 1635/4885ADRB3 593/4885

“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.