SCHEMBL813181

SCHEMBL813181

CC[C@@H](c1ccccc1)N(c1ccccc1)P(=O)(O)S

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.40
LMNA P02545 1/20 0.38
AOC3 Q16853 1/20 0.37
POLB P06746 1/20 0.37
TP53 P04637 2/20 0.36
MAPT P10636 2/20 0.36
ACP3 P15309 1/20 0.36
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL28238546 0.72 LMNA (0.46) TRPM8LMNAAOC3TP53MAPT
SCHEMBL11141579 0.71 LMNA (0.47) TRPM8LMNAAOC3TP53MAPT
SCHEMBL1031859 0.68 LMNA (0.52) TRPM8LMNAAOC3POLBMEN1
Bromide SCHEMBL4071099 0.68 HTR2A (0.46) TRPM8LMNAAOC3MEN1KMT2A
SCHEMBL8576434 0.68 LMNA (0.52) TRPM8LMNAAOC3POLBMEN1
SCHEMBL26638387 0.67 TRPM8 (0.47) TRPM8LMNAAOC3POLBMEN1
SCHEMBL394801 0.67 KCNA5 (0.47) TP53MEN1HTTKMT2AALDH1A1
Bromide SCHEMBL6625831 0.66 MEN1 (0.45) TRPM8LMNAAOC3TP53MAPT
Phosphoric Acid SCHEMBL9105394 0.66 LMNA (0.50) SRCLMNAAOC3POLBACP3
SCHEMBL1542690 0.66 SRC (0.50) SRCLMNAPOLBACP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8058210-B2 Arylphenyl-substituted cyclic keto-enols BAYER CROPSCIENCE AG (DE) 2011-11-15 US disclosed
US-20100087320-A1 ARYLPHENYL-SUBSTITUTED CYCLIC KETO-ENOLS LIEB FOLKER 2010-04-08 US disclosed
US-6221862-B1 Microbicide 1,4,2-dioxazine derivatives BAYER AKTIENGESELLSCHAFT (DE) 2001-04-24 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 (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-20100087320-A1 ARYLPHENYL-SUBSTITUTED CYCLIC KETO-ENOLS KCNE1, DDT, KCNQ3 SRC 860/4885TRPM8 4673/4885LMNA 2176/4885

“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.