SCHEMBL967918

SCHEMBL967918

Cc1cccc(C)c1P(=O)(O)c1c(C)cccc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.42
ACP3 P15309 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2A6 P11509 1/20 0.39
TRPA1 O75762 2/20 0.39
ATM Q13315 1/20 0.39
ACHE P22303 1/20 0.38
CA2 P00918 2/20 0.38
CA1 P00915 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
FDPS P14324 2/20 0.36
TDP1 Q9NUW8 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
SCHEMBL17223190 0.84 CA2 (0.48) ALDH1A1TSHRLMNAACP3CA2
SCHEMBL7826685 0.84 ALDH1A1 (0.43) ALDH1A1TSHRLMNAACP3CYP1A2
SCHEMBL17223228 0.82 ALDH1A1 (0.42) ALDH1A1TSHRLMNAACP3CYP1A2
Hydrochloric Acid SCHEMBL10912515 0.82 ALDH1A1 (0.42) ALDH1A1TSHRLMNAACP3CYP1A2
SCHEMBL1726840 0.80 CYP2A6 (0.45) ALDH1A1TSHRCYP1A2CYP2A6TRPA1
SCHEMBL2342981 0.77 TRPA1 (0.48) ALDH1A1TSHRLMNAACP3TRPA1
SCHEMBL10929953 0.76 ALDH1A1 (0.46) ALDH1A1TSHRACP3CYP1A2CYP2A6
SCHEMBL21621579 0.76 HPGD (0.43) ALDH1A1TSHRCYP1A2CYP2A6TRPA1
Phosphoric Acid SCHEMBL30528979 0.76 TRPA1 (0.52) ALDH1A1TSHRLMNAACP3CYP1A2
Phosphoric Acid SCHEMBL27222307 0.76 TRPA1 (0.52) ALDH1A1TSHRLMNAACP3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822425-B2 Processes for recovering metals from aqueous solutions CYTEC TECHNOLOGY CORP. (US) 2017-11-21 US disclosed
US-9670240-B2 Cyclic phosphinate derivatives and method of preparing the same KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2017-06-06 US disclosed
US-20170022229-A1 NOVEL CYCLIC PHOSPHINATE DERIVATIVES AND METHOD OF PREPARING THE SAME KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2017-01-26 US disclosed
US-9487547-B2 Cyclic phosphinate derivatives and method of preparing the same KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2016-11-08 US disclosed
US-20150315219-A1 NOVEL CYCLIC PHOSPHINATE DERIVATIVES AND METHOD OF PREPARING THE SAME KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2015-11-05 US disclosed
US-20150135903-A1 PROCESSES FOR RECOVERING METALS FROM AQUEOUS SOLUTIONS CYTEC TECHNOLOGY CORP. (US) 2015-05-21 US disclosed
US-8968698-B2 Processes for recovering metals from aqueous solutions CYTEC TECHNOLOGY CORP. (US) 2015-03-03 US disclosed
US-20140127095-A1 PROCESSES FOR RECOVERING METALS FROM AQUEOUS SOLUTIONS CYTEC TECHNOLOGY CORP. (US) 2014-05-08 US disclosed
US-8328900-B2 Processes for recovering metals from aqueous solutions CYTEC TECHNOLOGY CORP. (US) 2012-12-11 US disclosed
EP-2451985-A2 PROCESSES FOR RECOVERING METALS FROM AQUEOUS SOLUTIONS Cytec Technology Corporation (US) 2012-05-16 EP disclosed
WO-2011005736-A2 PROCESSES FOR RECOVERING METALS FROM AQUEOUS SOLUTIONS CYTEC TECHNOLOGY CORP. (US) 2011-01-13 WO disclosed
US-20110005354-A1 PROCESSES FOR RECOVERING METALS FROM AQUEOUS SOLUTIONS CYTEC TECHNOLOGY CORP. (US) 2011-01-13 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-20170022229-A1 NOVEL CYCLIC PHOSPHINATE DERIVATIVES AND METHOD OF PREPARING THE SAME PPOX, PNPO, PRDX5 ALDH1A1 3102/4885TSHR 2557/4885LMNA 3913/4885
US-20150315219-A1 NOVEL CYCLIC PHOSPHINATE DERIVATIVES AND METHOD OF PREPARING THE SAME PPOX, PNPO, PRDX5 ALDH1A1 3102/4885TSHR 2557/4885LMNA 3913/4885

“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.