SCHEMBL14949199

SCHEMBL14949199

Cc1cccc(Nc2nnc(-c3ccc(Oc4ncnc5[nH]ccc45)cc3)o2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 3/20 0.49
TTBK2 Q6IQ55 3/20 0.49
TRPA1 O75762 4/20 0.47
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDR P35968 4/20 0.44
TNNI3K Q59H18 2/20 0.44
BRAF P15056 1/20 0.44
MAPK14 Q16539 1/20 0.44
GSK3B P49841 2/20 0.43
KDM4E B2RXH2 1/20 0.40
MET P08581 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL14949361 0.92 TTBK1 (0.48) TTBK1TTBK2TRPA1MEN1NPC1
SCHEMBL12336389 0.86 KDR (0.61) TTBK1TTBK2TRPA1KDRTNNI3K
SCHEMBL16786017 0.81 TRPA1 (0.47) TTBK1TTBK2TRPA1NPC1TP53
SCHEMBL14949390 0.80 TTBK1 (0.50) TTBK1TTBK2TRPA1TP53KDR
SCHEMBL14949249 0.79 NPC1 (0.47) MEN1NPC1TP53MAPK1RAB9A
SCHEMBL12336436 0.79 KDR (0.56) TTBK1TTBK2TRPA1KDRTNNI3K
SCHEMBL12057529 0.77 MEN1 (0.52) MEN1NPC1TP53MAPK1RAB9A
SCHEMBL14949189 0.77 MEN1 (0.54) MEN1NPC1TP53MAPK1RAB9A
SCHEMBL14949194 0.76 NPC1 (0.48) MEN1NPC1TP53MAPK1RAB9A
SCHEMBL14949259 0.74 NPC1 (0.46) MEN1NPC1TP53MAPK1RAB9A

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-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-04-07 US disclosed
US-9212151-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-12-15 US disclosed
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2015-06-11 US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 US disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 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 (3 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-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION MAP4K2, MAP3K20, MAP3K19 TTBK1 221/4885TTBK2 185/4885TRPA1 3600/4885
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 TTBK1 221/4885TTBK2 185/4885TRPA1 3600/4885
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 TTBK1 221/4885TTBK2 185/4885TRPA1 3600/4885

“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.