SCHEMBL1844372

SCHEMBL1844372

Cc1nccn1Cc1ccc(-c2ccccc2Nc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
JAK2 O60674 1/20 0.45
LIMK2 P53671 1/20 0.44
AGTR2 P50052 2/20 0.43
GPR142 Q7Z601 1/20 0.43
AGTR1 P30556 1/20 0.43
ITGB1 P05556 3/20 0.39
ITGA4 P13612 3/20 0.39
GRM2 Q14416 1/20 0.39
TNIK Q9UKE5 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL1842616 0.89 NPC1 (0.45) LMNAL3MBTL1RAB9ANPC1JAK2
Hydrochloric Acid SCHEMBL7837417 0.83 LMNA (0.55) LMNAL3MBTL1RAB9ANPC1SMN1; SMN2
SCHEMBL15071657 0.80 LMNA (0.55) LMNAL3MBTL1JAK2AGTR2GPR142
SCHEMBL1841697 0.78 NPC1 (0.43) LMNARAB9ANPC1
SCHEMBL1839002 0.78 LMNA (0.52) LMNAL3MBTL1RAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL7837414 0.77 LMNA (0.51) LMNAL3MBTL1RAB9ANPC1SMN1; SMN2
SCHEMBL1844688 0.77 SOS1 (0.57) L3MBTL1ITGB1ITGA4ALDH1A1
SCHEMBL81625 0.77 LMNA (0.63) LMNAL3MBTL1RAB9ANPC1SMN1; SMN2
SCHEMBL31729500 0.77 LMNA (0.68) LMNAL3MBTL1JAK2GPR142GRM2
Benzene SCHEMBL27902631 0.77 LMNA (0.63) LMNAL3MBTL1RAB9ANPC1SMN1; SMN2

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-8236843-B2 Anti inflammatory compounds ELDER PHARMACEUTICALS LTD. (IN) 2012-08-07 US claimed
US-20110263543-A1 ANTI INFLAMMATORY COMPOUNDS ELDER PHARMACEUTICALS LTD. (IN) 2011-10-27 US claimed
EP-2321281-A2 ANTI INFLAMMATORY COMPOUNDS Elder Pharmaceuticals Ltd (IN) 2011-05-18 EP claimed
WO-2010029576-A2 ANTI INFLAMMATORY COMPOUNDS ELDER PHARMACEUTICALS LTD. (IN) 2010-03-18 WO claimed

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-20110263543-A1 ANTI INFLAMMATORY COMPOUNDS IL1B, LITAF, IL6 LMNA 2386/4885L3MBTL1 4726/4885RAB9A 2557/4885

“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.