SCHEMBL17265459

SCHEMBL17265459

OC(CCCc1ccccc1)c1cnoc1-c1ccc(Br)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.38
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
HSP90AA1 P07900 2/20 0.36
SIGMAR1 Q99720 1/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PPARA Q07869 1/20 0.35
HDAC3 O15379 1/20 0.35
NPC1 O15118 1/20 0.35
KMT2A Q03164 1/20 0.34
PLAAT3 P53816 1/20 0.34
PLAAT5 Q96KN8 1/20 0.34
PLAAT2 Q9NWW9 1/20 0.34
PLAAT4 Q9UL19 1/20 0.34

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
SCHEMBL6838 0.77 L3MBTL1 (0.40) CNR1CNR2HSP90AA1SIGMAR1RAB9A
SCHEMBL2761328 0.72 RAB9A (0.41) CNR2RAB9AL3MBTL1LMNASMN1; SMN2
SCHEMBL9915916 0.70 NLRP3 (0.42) SIGMAR1SMN1; SMN2HDAC3
SCHEMBL9915930 0.69 KDM6B (0.41) FAAHHDAC3
SCHEMBL9899639 0.69 KDM6B (0.40) FAAH
SCHEMBL9900014 0.67 HPGD (0.41) FAAHKMT2A
SCHEMBL12091 0.66 TSHR (0.41) FAAHRAB9AL3MBTL1SMN1; SMN2NPC1
SCHEMBL9901072 0.65 LTB4R (0.44) SMN1; SMN2HDAC3
SCHEMBL5774064 0.65 PPARA (0.42) RAB9AL3MBTL1LMNASMN1; SMN2PPARA
SCHEMBL9915921 0.65 GRIK1 (0.40) SMN1; SMN2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9624182-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
US-9624182-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
US-20150329502-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2015-11-19 US disclosed
US-20150329502-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2015-11-19 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-20150329502-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR4 FAAH 213/4885CNR1 29/4885CNR2 34/4885

“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.