SCHEMBL17838433

SCHEMBL17838433

O=C(Cc1ccc(Cl)c(F)c1)c1cc(O)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 4/20 0.57
LMNA P02545 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HTT P42858 2/20 0.55
ESR1 P03372 1/20 0.53
SHBG P04278 1/20 0.53
ESR2 Q92731 1/20 0.53
MAPT P10636 3/20 0.51
TP53 P04637 3/20 0.51
CHRNA7 P36544 1/20 0.49
ALOX5 P09917 2/20 0.48
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
GAA P10253 1/20 0.48
ALOX12 P18054 1/20 0.48
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 2/20 0.46
MEN1 O00255 1/20 0.45
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL16322177 0.80 LMNA (0.77) PIK3CALMNASMN1; SMN2HTTESR1
SCHEMBL16324510 0.80 ESR1 (0.73) PIK3CALMNASMN1; SMN2HTTESR1
SCHEMBL9730612 0.78 ESR1 (0.71) PIK3CALMNASMN1; SMN2HTTESR1
SCHEMBL17838467 0.77 LMNA (0.58) PIK3CALMNASMN1; SMN2HTTESR1
SCHEMBL14855930 0.75 ESR1 (0.53) PIK3CALMNASMN1; SMN2HTTESR1
SCHEMBL31390314 0.75 ESR1 (0.53) PIK3CALMNASMN1; SMN2HTTESR1
SCHEMBL7029291 0.75 PIK3CA (0.70) PIK3CALMNASMN1; SMN2HTTMAPT
SCHEMBL9061935 0.73 ESR1 (0.59) PIK3CALMNASMN1; SMN2HTTESR1
SCHEMBL1150357 0.73 MAPT (0.44) PIK3CAMAPTMAPK1KMT2ACA2
SCHEMBL154404 0.73 CA2 (0.59) PIK3CALMNAHTTMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233818-A1 DERIVATIVES OF 2,3-DIPHENYLCHROMENE USEFUL FOR THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2017-10-25 EP disclosed
WO-2016097073-A1 DERIVATIVES OF 2,3-DIPHENYLCHROMENE USEFUL FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2016-06-23 WO disclosed
WO-2016097073-A1 DERIVATIVES OF 2,3-DIPHENYLCHROMENE USEFUL FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2016-06-23 WO disclosed
US-20160175284-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-06-23 US disclosed
US-20160175284-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-06-23 US disclosed
US-20160175284-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-06-23 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-20160175284-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ESR2, GPER1, ESR1 PIK3CA 1154/4885LMNA 2688/4885SMN1; SMN2 4496/4885

“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.