SCHEMBL17487543

SCHEMBL17487543

Nc1ccc2[nH]c(NCc3ccc(S(=O)(=O)c4ccc(Cl)cc4)cc3)nc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 2/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NOD1 Q9Y239 1/20 0.44
TP53 P04637 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 2/20 0.42
HDAC1 Q13547 1/20 0.41
TYMS P04818 1/20 0.40
PRMT1 Q99873 1/20 0.40
MAPT P10636 1/20 0.39
CHEK2 O96017 1/20 0.39
EGFR P00533 1/20 0.39
KDR P35968 1/20 0.39

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
SCHEMBL18965843 0.90 PRMT1 (0.51) FABP4MEN1KMT2ANPSR1NOD1
SCHEMBL17488201 0.86 RAB9A (0.45) FABP4MEN1KMT2ATP53RAB9A
SCHEMBL17487331 0.85 RAB9A (0.45) FABP4MEN1KMT2ATP53RAB9A
SCHEMBL17488059 0.82 TEC (0.45) FABP4TP53RAB9ASMN1; SMN2POLB
SCHEMBL17488036 0.79 RAB9A (0.50) MEN1KMT2ATP53RAB9ASMN1; SMN2
SCHEMBL17487664 0.79 DGAT1 (0.42) FABP4MEN1KMT2ATP53RAB9A
SCHEMBL17487542 0.79 HTR6 (0.41) FABP4MEN1KMT2ACA1CA2
SCHEMBL17487944 0.78 RAB9A (0.40) FABP4MEN1KMT2ATP53RAB9A
SCHEMBL17487385 0.77 RAB9A (0.58) MEN1KMT2ATP53RAB9ASMN1; SMN2
SCHEMBL17487957 0.77 CYP3A4 (0.41) FABP4MEN1KMT2ATP53RAB9A

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
WO-2016016421-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS INSTITUT PASTEUR KOREA (KR) 2016-02-04 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 (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 FABP4 3761/4885MEN1 4515/4885KMT2A 4213/4885

“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.