SCHEMBL7180862

SCHEMBL7180862

C=Cc1cccc(Cc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
TSHR P16473 1/20 0.52
CALM1 P0DP23 1/20 0.50
TP53 P04637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ELANE P08246 1/20 0.45
IDH1 O75874 1/20 0.44
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
FAAH O00519 1/20 0.43
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
HNF4A P41235 1/20 0.38
BCL2 P10415 1/20 0.38
BCL2L1 Q07817 1/20 0.38
ACMSD Q8TDX5 1/20 0.37
LTA4H P09960 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.36

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
SCHEMBL595537 0.94 TP53 (0.52) ALDH1A1TSHRCALM1TP53TDP1
SCHEMBL595507 0.90 TP53 (0.45) ALDH1A1TSHRCALM1TP53TDP1
Diphenylmethane SCHEMBL10934952 0.87 ALDH1A1 (0.70) ALDH1A1TSHRCALM1TP53TDP1
SCHEMBL22542506 0.85 CYP17A1 (0.42) TP53TDP1LTA4HLOXL2
SCHEMBL10616284 0.83 ALDH1A1 (0.52) ALDH1A1TSHRTP53TDP1FAAH
Styrene SCHEMBL9657977 0.81 TP53 (0.60) ALDH1A1TSHRTP53TDP1MAOA
SCHEMBL8441622 0.81 TEAD4 (0.47) ALDH1A1TSHRCALM1IDH1HNF4A
SCHEMBL417837 0.81 MAOA (0.58) ALDH1A1CALM1ELANEIDH1PRSS1
SCHEMBL595016 0.80 TP53 (0.52) ALDH1A1TSHRTP53TDP1FAAH
SCHEMBL29375309 0.80 TP53 (0.52) ALDH1A1TSHRTP53TDP1FAAH

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140275337-A1 CONTINUOUS PROCESSING OF ASPHALT FORMULATIONS BUILDING MATERIALS INVESTMENT CORPORATION (US) 2014-09-18 US claimed
EP-0283038-B1 (VINYLPHENYL)PHENYLMETHANE AND METHOD FOR PRODUCING (BENZOYLPHENYL)PROPIONIC ACID NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-06-12 EP claimed
US-4922052-A (Vinylphenyl)phenylmethane and method for producing (benzoylphenyl) propionic acid NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-05-01 US claimed
EP-0283038-A1 (Vinylphenyl)phenylmethane and method for producing (benzoylphenyl)propionic acid NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-21 EP claimed
JP-63230653-A None JP disclosed
JP-63230652-A None JP disclosed
JP-63230647-A None JP disclosed
US-20250257027-A1 SECOND GENERATION GRP94-SELECTIVE INHIBITORS UNIVERSITY OF KANSAS (US) 2025-08-14 US disclosed
US-12269798-B2 Second generation GRP94-selective inhibitors UNIVERSITY OF KANSAS (US) 2025-04-08 US disclosed
US-20210300872-A1 SECOND GENERATION GRP94-SELECTIVE INHIBITORS UNIVERSITY OF KANSAS 2021-09-30 US disclosed
US-11028041-B2 Second generation GRP94-selective inhibitors UNIVERSITY OF KANSAS (US) 2021-06-08 US disclosed
US-20200190017-A1 SECOND GENERATION GRP94-SELECTIVE INHIBITORS UNIVERSITY OF KANSAS 2020-06-18 US disclosed
EP-0283038-A1 (Vinylphenyl)phenylmethane and method for producing (benzoylphenyl)propionic acid NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-21 EP disclosed
EP-0283038-A1 (Vinylphenyl)phenylmethane and method for producing (benzoylphenyl)propionic acid NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-21 EP disclosed
US-4743497-A ASPHALT, ALKADIENE-VINYLARENE COPOLYMER, HYDROCARBON RESIN PHILLIPS PETROLEUM COMPANY (US) 1988-05-10 US disclosed
US-4479837-A Filament rein for cement impregnated with resin of thickenable composition based on an adduct of alkadiene polymers and acid anhydride PHILLIPS PETROLEUM COMPANY (US) 1984-10-30 US disclosed
US-4430465-A ALKADIENE-VINYLARENE COPOLYMER, PETROLEUM RESIN, BRANCHED AMINE, ANTISTRIPPING, FIBERS, MATS, COATINGS PHILLIPS PETROLEUM COMPANY (US) 1984-02-07 US disclosed
US-4423177-A WITH THICKENERS AND PEROXIDE PHILLIPS PETROLEUM COMPANY (US) 1983-12-27 US disclosed
US-4414340-A WITH REDUCED BLISTERING, POLYALKADIENE, PEROXIDE, POLYOFEFIN, FILLER, RELEASE AGENT, MOLDING PHILLIPS PETROLEUM COMPANY (US) 1983-11-08 US disclosed
US-4371635-A MOLDING MATERIALS; FLEXIBILITY; HARDNESS; TENSILE STRENGTH PHILLIPS PETROLEUM COMPANY (US) 1983-02-01 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 (5 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-12269798-B2 Second generation GRP94-selective inhibitors HSP90B1, HSP90AB2P, HSPE1 ALDH1A1 3322/4885TSHR 2005/4885CALM1 2173/4885
US-20210300872-A1 SECOND GENERATION GRP94-SELECTIVE INHIBITORS HSP90B1, HSP90AB2P, HSPE1 ALDH1A1 3322/4885TSHR 2005/4885CALM1 2173/4885
US-20250257027-A1 SECOND GENERATION GRP94-SELECTIVE INHIBITORS HSP90B1, HSP90AB2P, HSPE1 ALDH1A1 3289/4885TSHR 1925/4885CALM1 2110/4885
US-11028041-B2 Second generation GRP94-selective inhibitors HSP90B1, HSP90AB2P, HSPE1 ALDH1A1 3289/4885TSHR 1925/4885CALM1 2110/4885
US-20200190017-A1 SECOND GENERATION GRP94-SELECTIVE INHIBITORS HSP90B1, HSP90AB2P, HSPE1 ALDH1A1 3289/4885TSHR 1925/4885CALM1 2110/4885

“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.