SCHEMBL2018677

SCHEMBL2018677

CC(Cc1ccccc1)c1cccc(O)c1C(C)Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
POLB P06746 2/20 0.46
MAPK1 P28482 1/20 0.46
TAAR1 Q96RJ0 4/20 0.46
SIGMAR1 Q99720 4/20 0.46
SLC6A2 P23975 2/20 0.46
MAOA P21397 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
CYP2A6 P11509 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
SLC18A2 Q05940 1/20 0.43
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TRPA1 O75762 2/20 0.42
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL28263628 0.88 ESR1 (0.53) TSHRMAPK1TAAR1SIGMAR1SLC6A2
SCHEMBL2020911 0.86 SIGMAR1 (0.43) TSHRPOLBMAPK1TAAR1SIGMAR1
SCHEMBL1868728 0.85 TSHR (0.64) TSHRPOLBMAPK1TAAR1SIGMAR1
SCHEMBL28115795 0.82 TAAR1 (0.52) TSHRPOLBMAPK1TAAR1SIGMAR1
SCHEMBL3047457 0.80 TSHR (0.67) TSHRPOLBMAPK1TAAR1SIGMAR1
SCHEMBL1842356 0.79 TSHR (0.47) TSHRPOLBMAPK1GABRA1GABRB2
SCHEMBL1838330 0.79 TSHR (0.43) TSHRPOLBMAPK1TAAR1GABRA1
SCHEMBL1347498 0.79 TSHR (0.60) TSHRPOLBMAPK1TAAR1SIGMAR1
Benzene SCHEMBL1835281 0.77 TSHR (0.68) TSHRPOLBSLC6A2GABRA1GABRB2
SCHEMBL1840949 0.76 TSHR (0.45) TSHRPOLBMAPK1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110521291-A Carrier film and method for manufacturing electronic component MURATA MANUFACTURING CO 2019-11-29 CN disclosed
CN-110461909-A HIGH HEAT POLYCARBONATE AND POLYETHERIMIDE-SILOXANE COMPOSITIONS, METHODS OF MANUFACTURE, AND ARTICLES THEREOF SABIC GLOBAL TECHNOLOGIES BV 2019-11-15 CN disclosed
CN-110088198-A High flow, ductile poly (aliphatic ester-carbonate) compositions 沙特基础工业全球技术有限公司 2019-08-02 CN disclosed
CN-106604967-B Flame-retarded heat-conducting polymer composition with good flowability characteristics and application thereof 沙特基础工业全球技术公司 2019-07-16 CN disclosed
CN-109715691-A Anisotropic composite material based on polyisocyanates 科思创德国股份有限公司 2019-05-03 CN disclosed
CN-108752593-B A kind of preparation method and applications of polysiloxane-polycarbonate 广东伟的新材料股份有限公司 2019-04-30 CN disclosed
CN-109240060-A Image forming apparatus and image forming method 柯尼卡美能达株式会社 2019-01-18 CN disclosed
US-20110160476-A1 N-Substituted Carbamic Acid Ester Production Method and Isocyanate Production Method Using the N-Substituted Carbamic Acid Ester ASAHI KASEI CHEMICALS CORPORATION (JP) 2011-06-30 US disclosed
EP-0364792-B1 CARRIER FOR DYEING POLYESTER MATERIALS BAYER AG (DE) 1993-02-03 EP disclosed
US-4994089-A Synergistic BAYER AKTIENGESELLSCHAFT (DE) 1991-02-19 US disclosed
EP-0364792-A2 Carrier for dyeing polyester materials BAYER AG (DE) 1990-04-25 EP 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-20110160476-A1 N-Substituted Carbamic Acid Ester Production Method and Isocyanate Production Method Using the N-Substituted Carbamic Acid Ester ALKBH3, CPS1, APEH TSHR 2998/4885POLB 4314/4885MAPK1 4255/4885

“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.