SCHEMBL7056

SCHEMBL7056

Cc1noc(-c2ccc(Br)cc2)c1CNC(C)CCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.43
HSP90AA1 P07900 1/20 0.43
BCHE P06276 2/20 0.40
MEN1 O00255 3/20 0.40
SIGMAR1 Q99720 1/20 0.39
OPRK1 P41145 1/20 0.38
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ATM Q13315 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 1/20 0.36
LPAR1 Q92633 1/20 0.36
GAA P10253 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
SCHEMBL1347 0.84 KMT2A (0.43) KMT2AMEN1POLBSMN1; SMN2TP53
SCHEMBL1165 0.83 KMT2A (0.45) KMT2AHSP90AA1MEN1SIGMAR1POLB
SCHEMBL6464 0.82 MEN1 (0.55) KMT2AMEN1HPGDSMN1; SMN2L3MBTL1
SCHEMBL1690 0.77 LPAR1 (0.40) KMT2ABCHEMEN1HTTL3MBTL1
SCHEMBL1691 0.77 LPAR1 (0.40) KMT2ABCHEMEN1HTTL3MBTL1
SCHEMBL18597729 0.76 HSP90AA1 (0.38) KMT2AHSP90AA1SIGMAR1SMN1; SMN2ATM
SCHEMBL6841 0.75 CYP1A2 (0.38) KMT2AMEN1HTTSMN1; SMN2ATM
SCHEMBL1623 0.74 LMNA (0.45) KMT2AMEN1L3MBTL1LPAR1
SCHEMBL7057 0.74 L3MBTL1 (0.37) KMT2AHSP90AA1SIGMAR1SMN1; SMN2L3MBTL1
SCHEMBL10932 0.74 LPAR1 (0.45) KMT2AHSP90AA1SIGMAR1SMN1; SMN2L3MBTL1

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 7 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
EP-2483252-B1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS INC (US) 2017-03-08 EP disclosed
US-20150329502-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2015-11-19 US disclosed
US-9090573-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
US-20120289522-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS INC. 2012-11-15 US disclosed
EP-2483252-A2 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS Amira Pharmaceuticals, Inc. (US) 2012-08-08 EP disclosed
WO-2011041694-A2 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-07 WO 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-20120289522-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR4 KMT2A 2185/4885HSP90AA1 3807/4885BCHE 2946/4885
US-20150329502-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR4 KMT2A 2185/4885HSP90AA1 3807/4885BCHE 2946/4885

“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.