SCHEMBL15912480

SCHEMBL15912480

CC(=O)c1ccc(F)cc1Oc1ccc(Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.46
MAOA P21397 4/20 0.46
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
PNLIP P16233 1/20 0.40
LMNA P02545 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
SCN8A Q9UQD0 2/20 0.39
SCN10A Q9Y5Y9 2/20 0.39
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
AKR1A1 P14550 1/20 0.38
AKR1B1 P15121 1/20 0.38

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
SCHEMBL15897450 0.86 AKR1C3 (0.43) CYP2C9CYP2C19CYP3A4AKR1A1AKR1B1
SCHEMBL15912486 0.85 FFAR4 (0.49) CYP1A2KMT2AALDH1A1PNLIPLMNA
SCHEMBL7755868 0.81 LMNA (0.51) MAOBMAOAKMT2AALDH1A1LMNA
SCHEMBL19524135 0.79 SCN8A (0.58) MAOBMAOAPNLIPLMNASCN8A
SCHEMBL12726142 0.79 KMT2A (0.47) MAOBMAOAKMT2AALDH1A1PNLIP
SCHEMBL7755864 0.78 PTGDR2 (0.48) MAOBMAOAKMT2ALMNAPTGDR2
SCHEMBL9367885 0.78 PTGER4 (0.51) MAOBMAOACYP1A2CYP2C9CYP2C19
SCHEMBL19513719 0.77 NCEH1 (0.49) MAOBMAOACYP1A2CYP2C19KMT2A
SCHEMBL15897499 0.77 SCN8A (0.47) KMT2ASCN8ASCN10AHPGD
SCHEMBL12726149 0.76 POLB (0.46) MAOBMAOACYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140213538-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. 2014-07-31 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-20140213538-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR5 MAOB 2997/4885MAOA 2268/4885CYP1A2 4548/4885

“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.