SCHEMBL5024499

SCHEMBL5024499

CCCCc1ccc(OC)cc1F

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.49
CYP19A1 P11511 1/20 0.49
ESR2 Q92731 1/20 0.49
TYR P14679 1/20 0.46
TAAR1 Q96RJ0 2/20 0.43
ADRA1A P35348 1/20 0.43
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
POLB P06746 1/20 0.42
GRM2 Q14416 1/20 0.42

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
SCHEMBL11224282 0.95 ESR1 (0.47) ESR1CYP19A1ESR2TYRTAAR1
SCHEMBL9921244 0.89 TAAR1 (0.46) ESR1CYP19A1ESR2TAAR1ADRA1A
SCHEMBL19304105 0.87 CHRM2 (0.54) ESR1CYP19A1ESR2TAAR1ADRA1A
SCHEMBL23575258 0.85 ESR1 (0.47) ESR1CYP19A1ESR2TYRTAAR1
SCHEMBL30250416 0.85 ESR1 (0.47) ESR1CYP19A1ESR2TYRTAAR1
SCHEMBL27633878 0.84 ESR1 (0.69) ESR1CYP19A1ESR2TYRPOLB
SCHEMBL8132364 0.82 POLB (0.46) TAAR1ADRA1AKDM1AMAOAMAOB
SCHEMBL9417780 0.81 APLNR (0.58) TAAR1ADRA1A
SCHEMBL16772275 0.81 KMT2A (0.52) ESR1CYP19A1ESR2TYRTAAR1
SCHEMBL18402965 0.81 MTNR1A (0.48) ESR1CYP19A1ESR2TAAR1ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11247990-B1 Bicyclic fused pyridine compounds as inhibitors of TAM kinases ARRAY BIOPHARMA INC (US) 2022-02-15 US disclosed
EP-3271333-B1 USP7 INHIBITOR COMPOUNDS AND METHODS OF USE HOFFMANN LA ROCHE (CH) 2022-01-12 EP disclosed
EP-1971595-A2 CETP INHIBITORS Merck & Co., Inc. (US) 2008-09-24 EP disclosed
WO-2007081569-A2 CETP INHIBITORS MERCK & CO., INC. (US) 2007-07-19 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-11247990-B1 Bicyclic fused pyridine compounds as inhibitors of TAM kinases MAP3K1, MAP3K3, MAP3K2 ESR1 614/4885CYP19A1 1064/4885ESR2 726/4885

“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.