SCHEMBL17488249

SCHEMBL17488249

Cn1c(NCc2ccc(Oc3ncc(Cl)cn3)cc2)nc2c(F)cc(NC3COC3)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CDK2 P24941 1/20 0.33
CDK9 P50750 1/20 0.33
EGFR P00533 1/20 0.33
BTK Q06187 1/20 0.33
CYP3A4 P08684 1/20 0.32
DGAT2 Q96PD7 1/20 0.32
KDR P35968 1/20 0.32
VNN1 O95497 1/20 0.32
AXL P30530 1/20 0.32
P2RX3 P56373 6/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
CCND3 P30281 1/20 0.31
CDK6 Q00534 1/20 0.31

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
SCHEMBL17488248 0.92 P2RX3 (0.36) SMN1; SMN2CDK2CDK9EGFRBTK
SCHEMBL18965793 0.90 MAPT (0.37) NPC1RAB9ACDK2CDK9EGFR
SCHEMBL18965979 0.90 CYP3A4 (0.43) NPC1RAB9AKMT2ASMN1; SMN2CYP3A4
SCHEMBL18965925 0.86 NPC1 (0.41) NPC1RAB9AKMT2ASMN1; SMN2CDK2
SCHEMBL18965997 0.83 SCN9A (0.42) MAPTLMNA
SCHEMBL18965840 0.81 NPC1 (0.41) NPC1RAB9AKMT2ASMN1; SMN2CDK2
SCHEMBL18960467 0.80 PLK4 (0.40) CDK9EGFRBTKKDR
SCHEMBL18965857 0.79 TP53 (0.37) NPC1RAB9ASMN1; SMN2EGFRBTK
SCHEMBL18965929 0.79 PPARG (0.42) NPC1RAB9AKMT2ASMN1; SMN2CDK2
SCHEMBL18964927 0.79 EGFR (0.33) NPC1RAB9AKMT2ASMN1; SMN2EGFR

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 NPC1 2764/4885RAB9A 3982/4885KMT2A 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.