SCHEMBL15944965

SCHEMBL15944965

COc1ccc2[nH]c(NC(=O)C3CC3c3ccccc3)nc2c1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR2 Q9HBW0 4/20 0.63
ITK Q08881 5/20 0.61
RAB9A P51151 4/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
NPC1 O15118 3/20 0.48
RXFP1 Q9HBX9 1/20 0.48
PKM P14618 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 2/20 0.47
CYP1A2 P05177 1/20 0.47
LMNA P02545 1/20 0.47
LCK P06239 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL15944954 0.87 LPAR2 (0.67) LPAR2ITKRAB9AMEN1KMT2A
SCHEMBL15944976 0.87 LPAR2 (0.76) LPAR2ITKRAB9AMEN1KMT2A
SCHEMBL15939272 0.85 LPAR2 (0.68) LPAR2RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL15944985 0.84 LPAR2 (0.84) LPAR2RAB9AMEN1KMT2ANPC1
SCHEMBL15944983 0.83 LPAR2 (0.63) LPAR2ITKRAB9ANPC1PKM
SCHEMBL15938994 0.83 LPAR2 (0.77) LPAR2RAB9ANPC1PKMSMN1; SMN2
SCHEMBL15944968 0.83 LPAR2 (0.71) LPAR2ITKSMN1; SMN2MAPTCYP1A2
SCHEMBL15945001 0.82 LPAR2 (0.55) LPAR2ITKCYP1A2
SCHEMBL15944962 0.82 LPAR2 (0.64) LPAR2ITKRAB9ANPC1SMN1; SMN2
SCHEMBL15944967 0.81 LPAR2 (0.63) LPAR2RAB9ANPC1SMN1; SMN2MAPT

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 2/4885ITK 3603/4885RAB9A 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.