SCHEMBL14949332

SCHEMBL14949332

Cc1cccc(Nc2nnc(-c3cccc(Oc4cc(C)nc(N)n4)c3)[nH]2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NOD1 Q9Y239 1/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 1/20 0.35
NUDT1 P36639 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
CYP2D6 P10635 1/20 0.34
ADORA2A P29274 1/20 0.33

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
SCHEMBL14949316 0.92 RAB9A (0.36) RAB9ANPC1SMN1; SMN2NOD1MAPT
SCHEMBL14949331 0.89 RAB9A (0.39) RAB9ANPC1SMN1; SMN2NOD1MAPT
SCHEMBL14949368 0.89 RAB9A (0.36) RAB9ANPC1SMN1; SMN2NOD1MAPT
SCHEMBL12336526 0.88 HTT (0.47) MAPTKMT2ALMNAADORA2AABCG2
SCHEMBL14949309 0.87 ROCK1 (0.40) RAB9ANPC1NOD1MEN1KMT2A
SCHEMBL14949359 0.86 KDR (0.35) RAB9ANPC1NOD1MAPTMEN1
SCHEMBL14949349 0.86 NPC1 (0.32) RAB9ANPC1NOD1MAPTTP53
SCHEMBL14949352 0.86 PDGFRB (0.35) RAB9ANPC1SMN1; SMN2NOD1MAPT
SCHEMBL17658746 0.85 NPC1 (0.37) RAB9ANPC1SMN1; SMN2NOD1MAPT
SCHEMBL14949341 0.84 MEN1 (0.37) MAPTCYP1A2MEN1KMT2ACYP2C9

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 RAB9A 1281/4885NPC1 3866/4885SMN1; SMN2 4181/4885
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 RAB9A 1281/4885NPC1 3866/4885SMN1; SMN2 4181/4885
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 RAB9A 1281/4885NPC1 3866/4885SMN1; SMN2 4181/4885

“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.