SCHEMBL81550

SCHEMBL81550

CCc1ccc(CCO)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.59
TAAR1 Q96RJ0 1/20 0.56
TDP1 Q9NUW8 1/20 0.55
CYP4F2 P78329 3/20 0.50
CYP4A11 Q02928 3/20 0.50
LPL P06858 1/20 0.48
LIPG Q9Y5X9 1/20 0.48
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TSHR P16473 1/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALOX5 P09917 1/20 0.46

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
SCHEMBL40656 0.85 CA2 (0.77) CA2TAAR1TDP1CYP4F2CYP4A11
SCHEMBL79488 0.84 CYP4A11 (0.57) CA2TAAR1CYP4F2CYP4A11LPL
SCHEMBL7643947 0.83 CA2 (0.59) CA2TDP1CYP4F2CYP4A11LPL
SCHEMBL9208507 0.82 CYP4A11 (0.58) CA2TAAR1CYP4F2CYP4A11LPL
SCHEMBL6057959 0.82 CA2 (0.72) CA2TDP1CYP4F2CYP4A11CA12
SCHEMBL6546733 0.82 TAAR1 (0.68) CA2TAAR1TDP1LPLLIPG
Alcohol SCHEMBL27952977 0.82 LPL (0.57) CA2TAAR1TDP1LPLLIPG
Ammonia Solution, Strong SCHEMBL9651935 0.81 CA2 (0.56) CA2TDP1CYP4F2CYP4A11LPL
SCHEMBL9027695 0.80 CYP4A11 (0.56) CA2TAAR1CYP4F2CYP4A11LPL
SCHEMBL16807165 0.80 BACE1 (0.42) CA2TAAR1TDP1CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1039411-A The short residence time(SRT) evaporation of right-acetoxyl phenylmethylcarbinol HOECHST CELANESE CORP (US) 1990-02-07 CN claimed
WO-2024077298-A1 DURABLE GRAPHENE OXIDE MEMBRANES COMPRISING FUNCTIONALIZED SUPPORT COMPONENTS VIA SEPARATIONS, INC. (US) 2024-04-11 WO disclosed
US-20230150974-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2023-05-18 US disclosed
CN-112047797-B Method for preparing alpha-alkyl substituted ketone compound 赣南医学院 2023-04-07 CN disclosed
US-20220362396-A1 AMINO-PYRAZINECARBOXAMIDE COMPOUNDS, CONJUGATES, AND USES THEREOF SILVERBACK THERAPEUTICS, INC. 2022-11-17 US disclosed
EP-3656403-B1 PREPARATION PROCESS OF PSMA BINDING LIGAND-LINKER CONJUGATES PURDUE RESEARCH FOUNDATION (US) 2022-05-11 EP disclosed
WO-2022026823-A1 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CHAN ZUCKERBERG BIOHUB, INC. (US) 2022-02-03 WO disclosed
EP-3906969-A1 ANTIHYPERTENSIVE POLYOL COMPOUND AND DERIVATIVE THEREOF East China University of Science and Technology (CN) 2021-11-10 EP disclosed
WO-2021102332-A1 TGFBETAR2 INHIBITOR-LRRC15 ANTIBODY CONJUGATES AND USES THEREOF SILVERBACK THERAPEUTICS, INC. (US) 2021-05-27 WO disclosed
CN-112047797-A Method for preparing alpha-alkyl substituted ketone compound 赣南医学院 2020-12-08 CN disclosed
US-5091422-A Treating inflammatory or allergic skin disease, lowering gastric acidity GLAXO GROUP LIMITED (GB) 1992-02-25 US disclosed
EP-0454501-A2 Benzylidenethiazolidine derivatives, their preparation and their use for the inhibition of lipid peroxides Sankyo Company Limited (JP) 1991-10-30 EP disclosed
US-4992474-A Adrenergic stimulants GLAXO GROUP LTD. (GB) 1991-02-12 US disclosed
EP-0393607-A2 Phenylcarboxylic acid derivatives having a hetero ring OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-10-24 EP disclosed
EP-0368670-A1 Trisubstituted piperazine compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1990-05-16 EP disclosed
EP-0192111-B1 ISO-UREAS, PROCESSES FOR THEIR PRODUCTION AND THEIR USE AS HERBICIDES BASF Aktiengesellschaft (DE) 1990-05-16 EP disclosed
EP-0191394-B1 ISOTHIOUREAS, PROCESS FOR THEIR PREPARATION AND THEIR USE TO COMBAT UNDESIRABLE PLANT GROWTH BASF Aktiengesellschaft (DE) 1989-12-06 EP disclosed
US-4692187-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1987-09-08 US disclosed
US-4689068-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1987-08-25 US disclosed
EP-0192111-A1 Iso-ureas, processes for their production and their use as herbicides BASF Aktiengesellschaft (DE) 1986-08-27 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 (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-20230150974-A1 COMPOUNDS AND USES THEREOF VHL, CLN6, TFEB CA2 4715/4885TAAR1 4538/4885TDP1 725/4885
US-20220362396-A1 AMINO-PYRAZINECARBOXAMIDE COMPOUNDS, CONJUGATES, AND USES THEREOF TGFBR2, SMAD2, ACVR2A CA2 2677/4885TAAR1 903/4885TDP1 4328/4885

“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.