SCHEMBL343233

SCHEMBL343233

C[C@@H](O)c1ccccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.47
P2RX7 Q99572 1/20 0.47
PDE2A O00408 1/20 0.43
CNR2 P34972 2/20 0.42
HSD11B1 P28845 4/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MC4R P32245 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37

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
SCHEMBL29907993 1.00 ACP3 (0.47) ACP3P2RX7PDE2ACNR2HSD11B1
SCHEMBL29580255 1.00 ACP3 (0.47) ACP3P2RX7PDE2ACNR2HSD11B1
SCHEMBL1047627 1.00 ACP3 (0.47) ACP3P2RX7PDE2ACNR2HSD11B1
SCHEMBL13168657 1.00 ACP3 (0.47) ACP3P2RX7PDE2ACNR2HSD11B1
SCHEMBL2986939 1.00 ACP3 (0.47) ACP3P2RX7PDE2ACNR2HSD11B1
Phthalic Acid SCHEMBL3626025 0.86 TAS2R14 (0.48) ACP3P2RX7CNR2ALDH1A1LMNA
Phthalic Acid SCHEMBL3626023 0.86 TAS2R14 (0.48) ACP3P2RX7CNR2ALDH1A1LMNA
SCHEMBL8539373 0.83 ACP3 (0.49) ACP3P2RX7PDE2ACNR2HSD11B1
SCHEMBL84477 0.82 P2RX7 (0.50) ACP3P2RX7CNR2HSD11B1SMN1; SMN2
SCHEMBL9776265 0.82 ACP3 (0.50) ACP3P2RX7CNR2ALDH1A1MC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107118986-B Pseudomonas putida and application thereof in preparation of (R) -1- (2-trifluoromethylphenyl) ethanol 浙江医药高等专科学校 2020-08-11 CN claimed
CN-107746861-B Biological preparation method of (R) -1- (2-trifluoromethylphenyl) ethanol 浙江工业大学 2020-06-23 CN claimed
US-20230250093-A1 AMIDO CYCLOHEXANE ACID DERIVATIVES AS LPA RECEPTOR INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2023-08-10 US disclosed
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-11548871-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2023-01-10 US disclosed
CN-112176019-B Method for preparing (R) -1- (3-trifluoromethylphenyl) ethanol by biological catalysis 浙江工业大学 2022-03-18 CN disclosed
US-20210171500-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2021-06-10 US disclosed
CN-112176019-A Method for preparing (R) -1- (3-trifluoromethylphenyl) ethanol by biological catalysis 浙江工业大学 2021-01-05 CN disclosed
CN-107118986-B Pseudomonas putida and application thereof in preparation of (R) -1- (2-trifluoromethylphenyl) ethanol 浙江医药高等专科学校 2020-08-11 CN disclosed
CN-107118986-B Pseudomonas putida and application thereof in preparation of (R) -1- (2-trifluoromethylphenyl) ethanol 浙江医药高等专科学校 2020-08-11 CN disclosed
US-20110054223-A1 Method for Purifying Optically Active 1-(2-Trifluoromethylphenyl)Ethanol CENTRAL GLASS COMPANY, LIMITED (JP) 2011-03-03 US disclosed
WO-2010141768-A2 POLYCYCLIC ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-12-09 WO disclosed
WO-2010141768-A2 POLYCYCLIC ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-12-09 WO disclosed
WO-2010141761-A2 POLYCYCLIC ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-12-09 WO disclosed
US-20100311799-A1 POLYCYCLIC ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-12-09 US disclosed
EP-2248795-A1 METHOD FOR PURIFYING OPTICALLY ACTIVE 1-(2-TRIFLUOROMETHYLPHENYL)ETHANOL Central Glass Company, Limited (JP) 2010-11-10 EP disclosed
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2010-11-04 US disclosed
WO-2009003911-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2009-01-08 WO disclosed
EP-1935866-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE FLUOROBENZYL ALCOHOL Central Glass Company, Limited (JP) 2008-06-25 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 (7 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-20110054223-A1 Method for Purifying Optically Active 1-(2-Trifluoromethylphenyl)Ethanol ADH1C, ADH1A, ADH5 ACP3 1689/4885P2RX7 4800/4885PDE2A 4319/4885
US-11548871-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof LPAR3, LPAR1, LPAR2 ACP3 250/4885P2RX7 526/4885PDE2A 1086/4885
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES PIKFYVE, PIP4K2B, PIP5K1B ACP3 2400/4885P2RX7 3076/4885PDE2A 1586/4885
US-20230250093-A1 AMIDO CYCLOHEXANE ACID DERIVATIVES AS LPA RECEPTOR INHIBITORS LPAR1, LPAR2, LPAR3 ACP3 1383/4885P2RX7 757/4885PDE2A 1172/4885
US-20210171500-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF LPAR3, LPAR1, LPAR2 ACP3 250/4885P2RX7 526/4885PDE2A 1086/4885
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF LPAR3, LPAR1, LPAR2 ACP3 250/4885P2RX7 526/4885PDE2A 1086/4885
US-20100311799-A1 POLYCYCLIC ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS LPAR1, LPAR2, LPAR4 ACP3 657/4885P2RX7 137/4885PDE2A 1909/4885

“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.