SCHEMBL18960441

SCHEMBL18960441

Cn1c(NCc2ccc(Oc3ncc(Cl)cc3F)cc2)nc2ccc(N)cc21

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 1/20 0.47
LTA4H P09960 7/20 0.43
KCNH2 Q12809 4/20 0.43
KDR P35968 1/20 0.42
CYP3A4 P08684 1/20 0.39
TP53 P04637 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
PTGER4 P35408 1/20 0.37
PTGER2 P43116 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL18960440 0.91 SMN1; SMN2 (0.46) PPARGNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL18960426 0.85 NPC1 (0.48) NPC1RAB9ASMN1; SMN2KMT2AKDR
SCHEMBL18960407 0.84 NPC1 (0.59) PPARGNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL17488172 0.84 CYP3A4 (0.54) PPARGNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL17488316 0.83 NPC1 (0.48) NPC1RAB9ASMN1; SMN2KMT2AKDR
SCHEMBL17488238 0.82 NPC1 (0.48) NPC1RAB9ASMN1; SMN2KMT2AKDR
SCHEMBL18965929 0.82 PPARG (0.42) PPARGNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL18960446 0.82 NPC1 (0.47) NPC1RAB9ASMN1; SMN2KMT2AKDR
SCHEMBL18960420 0.82 NPC1 (0.47) NPC1RAB9ASMN1; SMN2KMT2AKDR
SCHEMBL17487732 0.81 RAB9A (0.45) RAB9ASMN1; SMN2LTA4HKCNH2KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170166563-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS INSTITUT PASTEUR KOREA (KR) 2017-06-15 US disclosed
US-20170166563-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS INSTITUT PASTEUR KOREA (KR) 2017-06-15 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-20170166563-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS ALOX5, ALOX15, ALOX12 PPARG 472/4885NPC1 2764/4885RAB9A 3982/4885

“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.