SCHEMBL4026375

SCHEMBL4026375

CCCn1nc(-c2ccc(OC)cc2)c2cccc(C(F)(F)F)c21

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.60
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
ACP1 P24666 1/20 0.40
MAPT P10636 3/20 0.40
ESR2 Q92731 1/20 0.40
TP53 P04637 1/20 0.40
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 2/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
THRB P10828 1/20 0.38
RXFP1 Q9HBX9 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
SCHEMBL4025771 0.92 ESR1 (0.56) ESR1KDM4EALDH1A1HPGDACP1
SCHEMBL4035239 0.86 ESR1 (0.80) ESR1MAPTESR2NR1H2NR1H3
SCHEMBL4031181 0.84 ESR1 (0.54) ESR1KDM4EALDH1A1HPGDMAPT
SCHEMBL4031240 0.84 ESR1 (0.58) ESR1KDM4EALDH1A1HPGDACP1
SCHEMBL4031926 0.84 ESR1 (0.55) ESR1ESR2
SCHEMBL4027614 0.83 ESR1 (0.55) ESR1KDM4EALDH1A1HPGDMAPT
SCHEMBL4034796 0.83 ESR1 (0.73) ESR1KDM4EALDH1A1HPGDMAPT
SCHEMBL4027997 0.82 ESR1 (0.73) ESR1KDM4EALDH1A1HPGDMAPT
SCHEMBL4030378 0.81 ESR1 (0.53) ESR1KDM4EALDH1A1HPGDMAPT
SCHEMBL4035160 0.81 ESR1 (0.50) ESR1KDM4EALDH1A1HPGDMAPT

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
EP-1542976-B1 SUBSTITUTED 4-(INDAZOL-3-YL)PHENOLS AS ESTROGEN RECEPTOR (ER) LIGANDS AND THEIR USE IN THE TREATMENT OF INFLAMMATORY DISEASES WYETH CORP (US) 2009-02-04 EP disclosed
US-20070225349-A1 Substituted 4-(Indazol-3-yl)phenols WYETH (US) 2007-09-27 US disclosed
US-7241791-B2 Substituted 4-(indazol-3-yl)phenols WYETH (US) 2007-07-10 US disclosed
US-20040167127-A1 Substituted 4-(indazol-3-yl)phenols WYETH (US) 2004-08-26 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 (2 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-20070225349-A1 Substituted 4-(Indazol-3-yl)phenols INSR, TNNI3, INSRR ESR1 1028/4885KDM4E 339/4885ALDH1A1 2279/4885
US-20040167127-A1 Substituted 4-(indazol-3-yl)phenols INSR, MSR1, TNNI3 ESR1 2487/4885KDM4E 408/4885ALDH1A1 1965/4885

“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.