SCHEMBL15944979

SCHEMBL15944979

CN(C)c1cccc(C2CC2C(=O)Nc2nc3ccccc3[nH]2)c1

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR2 Q9HBW0 4/20 0.76
NPC1 O15118 6/20 0.61
RAB9A P51151 6/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
SMN1; SMN2 Q16637 4/20 0.52
CYP1A2 P05177 1/20 0.52
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 2/20 0.47
HTT P42858 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
CYP3A4 P08684 1/20 0.44

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
SCHEMBL15944948 0.89 LPAR2 (0.67) LPAR2NPC1RAB9AMEN1KMT2A
SCHEMBL15944953 0.86 LPAR2 (1.00) LPAR2NPC1RAB9AMEN1KMT2A
SCHEMBL15938994 0.85 LPAR2 (0.77) LPAR2NPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL15944961 0.84 LPAR2 (0.77) LPAR2NPC1RAB9AMEN1KMT2A
SCHEMBL15944974 0.84 LPAR2 (0.77) LPAR2NPC1RAB9AMEN1KMT2A
SCHEMBL15944971 0.84 LPAR2 (0.77) LPAR2NPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL15944976 0.84 LPAR2 (0.76) LPAR2NPC1RAB9AMEN1KMT2A
SCHEMBL15944978 0.82 LPAR2 (0.74) LPAR2NPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL15944972 0.81 LPAR2 (0.71) LPAR2NPC1RAB9AMEN1KMT2A
SCHEMBL15944952 0.81 LPAR2 (0.78) LPAR2NPC1RAB9AMEN1KMT2A

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-8912202-B2 N-(benzimimdazol-2-yl)-cyclopropane carboxamides as lysophosphatidic acid antagonists MERCK PATENT GMBH (DE) 2014-12-16 US disclosed
US-8912202-B2 N-(benzimimdazol-2-yl)-cyclopropane carboxamides as lysophosphatidic acid antagonists MERCK PATENT GMBH (DE) 2014-12-16 US disclosed
US-20140228378-A1 N-(Benzimimdazol-2-yl)-Cyclopropane Carboxamides as Lysophosphatidic Acid Antagonists MERCK PATENT GMBH (DE) 2014-08-14 US disclosed
US-20140228378-A1 N-(Benzimimdazol-2-yl)-Cyclopropane Carboxamides as Lysophosphatidic Acid Antagonists MERCK PATENT GMBH (DE) 2014-08-14 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-20140228378-A1 N-(Benzimimdazol-2-yl)-Cyclopropane Carboxamides as Lysophosphatidic Acid Antagonists LPAR5, LPAR2, LPAR1 LPAR2 2/4885NPC1 1073/4885RAB9A 2691/4885

“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.