SCHEMBL16964110

SCHEMBL16964110

CCC(CC)(CN)Oc1ccc(N)nc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 1/20 0.37
▸ TPO P07202 1/20 0.37
▸ EPX P11678 1/20 0.37
▸ LPO P22079 1/20 0.37
▸ NOS3 P29474 1/20 0.37
▸ NOS2 P35228 1/20 0.37
▸ LTA4H P09960 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ TSHR P16473 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ NPC1 O15118 3/20 0.32
▸ RAB9A P51151 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NCF1 P14598 2/20 0.31
▸ GABRP O00591 1/20 0.31
▸ GABRD O14764 1/20 0.31
▸ GABRA1 P14867 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
SCHEMBL18872377 0.79 KDM4E (0.40) MPOTPOEPXLPONOS3
SCHEMBL17471316 0.74 NOS3 (0.45) MPOTPOEPXLPONOS3
SCHEMBL360929 0.72 TDP1 (0.56) MPOTPOEPXLPONOS3
SCHEMBL19184855 0.72 KDM4E (0.37) MPOTPOEPXLPOKDM4E
Cyanide SCHEMBL28324078 0.72 TDP1 (0.50) MPOTPOEPXLPONOS3
SCHEMBL1985113 0.72 KDM1A (0.30) NPC1RAB9AMAPT
SCHEMBL29603339 0.71 ALOX5AP (0.49) MPOTPOEPXLPONOS3
SCHEMBL2305476 0.71 ALOX5AP (0.49) MPOTPOEPXLPONOS3
SCHEMBL20576389 0.70 CHRNB2 (0.35) —
SCHEMBL1920453 0.69 RAB9A (0.54) MPOTPOEPXLPONOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9714247-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2017-07-25 — — US disclosed
US-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-04-20 — — US disclosed
US-9493454-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2016-11-15 — — US disclosed
US-20150266870-A1 MULTIPLE KINASE PATHWAY INHIBITORS MANNKIND CORPORATION 2015-09-24 — — US disclosed
EP-2900668-A1 MULTIPLE KINASE PATHWAY INHIBITORS MannKind Corporation (US) 2015-08-05 — — EP 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 (2 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-20150266870-A1 MULTIPLE KINASE PATHWAY INHIBITORS MAP3K6, MAP3K2, MAP3K1 MPO 4509/4885TPO 4602/4885EPX 3457/4885
US-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS MAP3K6, MAP3K2, MAP3K1 MPO 4509/4885TPO 4602/4885EPX 3457/4885

“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.

Send feedback