SCHEMBL7540746

SCHEMBL7540746

FC(F)(F)c1cccc(Oc2cc(-c3ccc(Cl)cc3)ncn2)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.56
NPC1 O15118 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 1/20 0.44
P2RY1 P47900 1/20 0.43

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
SCHEMBL4244096 0.82 L3MBTL1 (0.57) TRPV1CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL7783065 0.81 ALDH1A1 (0.54) RAB9AALDH1A1POLBL3MBTL1MAPT
SCHEMBL8773803 0.80 ALDH1A1 (0.53) RAB9AALDH1A1POLBL3MBTL1MAPT
SCHEMBL1041705 0.80 TRPV1 (0.61) TRPV1NPC1CYP1A2CYP2C9CYP2C19
SCHEMBL7545999 0.80 TRPV1 (0.50) TRPV1NPC1CYP1A2CYP2C9CYP2C19
SCHEMBL1042846 0.80 TRPV1 (0.61) TRPV1NPC1CYP1A2CYP2C9CYP2C19
SCHEMBL5968384 0.78 TRPV1 (0.59) TRPV1NPC1CYP1A2CYP2C9CYP2C19
SCHEMBL7780979 0.77 ALDH1A1 (0.52) TRPV1ALDH1A1POLBL3MBTL1MAPT
SCHEMBL7776086 0.77 ALDH1A1 (0.41) ALDH1A1POLBL3MBTL1MAPTP2RY1
SCHEMBL6180609 0.77 FFAR4 (0.50) CYP1A2CYP2C9CYP2C19SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020045634-A1 Use of aryl-substituted pyrimidines as insecticidal and acaricidal agents AMERICAN CYANAMID COMPANY 2002-04-18 US claimed
US-6153619-A Aryl-substituted pyrimidines as insecticidal and acaricidal agents AMERICAN CYANAMID COMPANY (US) 2000-11-28 US claimed

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-20020045634-A1 Use of aryl-substituted pyrimidines as insecticidal and acaricidal agents YBX1, YBX3, CYP1B1 TRPV1 3410/4885NPC1 1752/4885CYP1A2 143/4885

“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.