SCHEMBL17487449

SCHEMBL17487449

Nc1ccc2nc(N)n(Cc3ccc(Oc4ccc(Cl)cn4)c(F)c3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 10/20 0.46
SOS1 Q07889 2/20 0.46
TNF P01375 1/20 0.43
CXCL8 P10145 1/20 0.43
NOD2 Q9HC29 1/20 0.43
NOD1 Q9Y239 1/20 0.43
P2RX3 P56373 5/20 0.41
KMT2A Q03164 2/20 0.40
NTRK1 P04629 1/20 0.38
NTRK2 Q16620 1/20 0.38
GRM4 Q14833 1/20 0.37
MEN1 O00255 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
SCHEMBL17488006 0.90 KMT2A (0.47) CSF1RSOS1TNFCXCL8NOD2
SCHEMBL17487358 0.86 SOS1 (0.48) CSF1RSOS1TNFCXCL8NOD2
SCHEMBL17487454 0.83 CSF1R (0.50) CSF1RSOS1TNFCXCL8NOD2
SCHEMBL17487426 0.81 CXCL8 (0.50) CSF1RSOS1TNFCXCL8NOD2
SCHEMBL18960417 0.80 SMN1; SMN2 (0.43) P2RX3KMT2AGRM4MEN1
SCHEMBL17487402 0.78 ALDH1A1 (0.48) CSF1RSOS1TNFCXCL8NOD2
SCHEMBL18960413 0.77 CXCL8 (0.46) CSF1RSOS1TNFCXCL8NOD2
SCHEMBL25275508 0.77 MEN1 (0.55) P2RX3KMT2AGRM4MEN1
SCHEMBL30466069 0.77 MEN1 (0.55) P2RX3KMT2AGRM4MEN1
SCHEMBL17487315 0.76 SOS1 (0.59) CSF1RSOS1TNFCXCL8NOD2

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 3 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
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 CSF1R 1559/4885SOS1 4452/4885TNF 2621/4885

“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.