SCHEMBL3809767

SCHEMBL3809767

C=C(c1cccc(OCCCc2ccccc2C(=O)OC)c1)c1ccc2ccc(Cl)cc2n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR1 Q9Y271 2/20 0.41
▸ CYSLTR2 Q9NS75 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PLA2G2A P14555 1/20 0.37
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ KLKB1 P03952 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
SCHEMBL3773865 0.86 PLA2G2A (0.41) MAPTPLA2G2AALDH1A1LMNAHTT
SCHEMBL1401053 0.82 PLA2G2A (0.36) PLA2G2AALDH1A1LMNA
SCHEMBL3773863 0.82 PLA2G2A (0.36) PLA2G2AALDH1A1LMNA
SCHEMBL1401179 0.82 PLA2G2A (0.36) PLA2G2AALDH1A1LMNA
SCHEMBL3780082 0.81 ABCG2 (0.36) PLA2G2AALDH1A1LMNA
SCHEMBL3779589 0.81 PLA2G2A (0.36) PLA2G2A
SCHEMBL5816742 0.79 ALDH1A1 (0.46) MAPTPLA2G2AALDH1A1LMNAHTT
SCHEMBL4957637 0.78 MAPT (0.44) CYSLTR1CNR2MAPTL3MBTL1PLA2G2A
SCHEMBL9756946 0.76 CYSLTR2 (0.45) CYSLTR1CYSLTR2CNR2MAPTL3MBTL1
SCHEMBL1401054 0.73 PLA2G2A (0.38) MAPTPLA2G2AALDH1A1LMNAHTT

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
US-20080275243-A1 Process for the Preparation of Polymorphs, Solvates of Aripiprazole Using Aripiprazole Acid Salts SATYANARAYANA CHAVA 2008-11-06 — — US claimed
US-7858793-B2 Methyl 2-[(3S)-[3-[2E)-(7-chloro quinolin-2-yl) ethenyl] phenyl]-3-halopropyl] benzoates SATYANARAYANA CHAVA 2010-12-28 — — US disclosed
US-20080275243-A1 Process for the Preparation of Polymorphs, Solvates of Aripiprazole Using Aripiprazole Acid Salts SATYANARAYANA CHAVA 2008-11-06 — — 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-20080275243-A1 Process for the Preparation of Polymorphs, Solvates of Aripiprazole Using Aripiprazole Acid Salts HTR3C, HTR3B, TPMT CYSLTR1 3478/4885CYSLTR2 2907/4885CNR2 441/4885

“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.

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