SCHEMBL503196

SCHEMBL503196

Oc1ccc(C2=CCC(C3CC=C(c4ccc(O)cc4)CC3)CC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 6/20 0.62
QDPR P09417 2/20 0.46
DRD2 P14416 3/20 0.41
DRD3 P35462 3/20 0.41
DRD4 P21917 2/20 0.41
ESR1 P03372 3/20 0.40
MMP3 P08254 1/20 0.34
BCL2L1 Q07817 1/20 0.34
KDM1A O60341 1/20 0.34
MEN1 O00255 2/20 0.33
NPC1 O15118 2/20 0.33
MAPT P10636 2/20 0.33
NFKB1 P19838 2/20 0.33
RAB9A P51151 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
USP2 O75604 1/20 0.33
TP53 P04637 1/20 0.33
PKM P14618 1/20 0.33
NFKB2 Q00653 1/20 0.33

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
SCHEMBL14560140 0.91 ESR2 (0.54) ESR2QDPRDRD2DRD3DRD4
SCHEMBL14560139 0.85 ESR2 (0.49) ESR2QDPRDRD2DRD3DRD4
SCHEMBL9715313 0.82 ESR2 (0.61) ESR2QDPRDRD2DRD3DRD4
SCHEMBL10930951 0.80 ESR2 (0.59) ESR2QDPRDRD2DRD3DRD4
SCHEMBL2721633 0.79 ESR2 (0.57) ESR2QDPRESR1KDM1ACYP3A4
SCHEMBL10932344 0.79 ESR2 (0.57) ESR2QDPRDRD2DRD3DRD4
SCHEMBL20524227 0.77 ESR2 (1.00) ESR2QDPRDRD2DRD3DRD4
SCHEMBL9248162 0.77 ESR2 (0.56) ESR2QDPRDRD2DRD3DRD4
SCHEMBL503467 0.77 ESR2 (0.41) ESR2QDPRESR1TP53CYP3A4
SCHEMBL8102077 0.76 ESR2 (0.54) ESR2QDPRDRD2DRD3DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196232-B2 4,4′-dihydroxyphenyl bicyclohexenes HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2007-03-27 US claimed
US-20060129001-A1 Novel 4,4'-dihydroxyphenyl bicyclohexenes HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2006-06-15 US claimed
US-9310681-B2 Negative resist composition and patterning process using same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-04-12 US disclosed
US-9310681-B2 Negative resist composition and patterning process using same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-04-12 US disclosed
US-20150198883-A1 NEGATIVE RESIST COMPOSITION AND PATTERNING PROCESS USING SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-07-16 US disclosed
US-20150198883-A1 NEGATIVE RESIST COMPOSITION AND PATTERNING PROCESS USING SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-07-16 US disclosed
EP-2383265-B1 METHOD FOR MANUFACTURING TRIMELLITIC ANHYDRIDE ARYL ESTER HONSHU CHEMICAL IND (JP) 2015-03-11 EP disclosed
US-8563751-B2 Method for manufacturing trimellitic anhydride aryl ester HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2013-10-22 US disclosed
US-20120029215-A1 METHOD FOR MANUFACTURING TRIMELLITIC ANHYDRIDE ARYL ESTER HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2012-02-02 US disclosed
EP-2383265-A1 METHOD FOR MANUFACTURING TRIMELLITIC ANHYDRIDE ARYL ESTER Honshu Chemical Industry Co., Ltd. (JP) 2011-11-02 EP disclosed
US-7196232-B2 4,4′-dihydroxyphenyl bicyclohexenes HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2007-03-27 US disclosed
US-7196232-B2 4,4′-dihydroxyphenyl bicyclohexenes HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2007-03-27 US disclosed
US-20060129001-A1 Novel 4,4'-dihydroxyphenyl bicyclohexenes HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2006-06-15 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-20120029215-A1 METHOD FOR MANUFACTURING TRIMELLITIC ANHYDRIDE ARYL ESTER TRIM4, CA6, TRIM58 ESR2 4574/4885QDPR 3754/4885DRD2 4203/4885
US-20060129001-A1 Novel 4,4'-dihydroxyphenyl bicyclohexenes DBF4, DCUN1D4, SDC4 ESR2 2548/4885QDPR 885/4885DRD2 108/4885

“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.