SCHEMBL2229315

SCHEMBL2229315

Cc1ccnc(Nc2cccc(Br)n2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.44
▸ RAB9A P51151 5/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ PKM P14618 3/20 0.44
▸ TP53 P04637 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ GRM5 P41594 6/20 0.42
▸ KDR P35968 2/20 0.41
▸ ASIC3 Q9UHC3 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ CHEK1 O14757 1/20 0.40
▸ IKBKB O14920 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ PDPK1 O15530 1/20 0.40
▸ CHEK2 O96017 1/20 0.40
▸ PRKCG P05129 1/20 0.40
▸ CDK1 P06493 1/20 0.40
▸ LYN P07948 1/20 0.40
▸ MAPT P10636 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
SCHEMBL3957843 0.75 GRM5 (0.58) NPC1RAB9ASMN1; SMN2TP53GRM5
SCHEMBL901321 0.74 KARS1 (0.57) NPC1RAB9AKDRSYKKMT2A
SCHEMBL31143287 0.74 KDR (0.51) NPC1RAB9ASMN1; SMN2TP53LMNA
SCHEMBL14127502 0.74 KDR (0.51) NPC1RAB9ASMN1; SMN2TP53LMNA
SCHEMBL30641300 0.73 NPC1 (0.43) NPC1RAB9ASMN1; SMN2PKMTP53
SCHEMBL26674581 0.73 NPC1 (0.43) NPC1RAB9ASMN1; SMN2PKMTP53
SCHEMBL26674594 0.71 NPC1 (0.42) NPC1RAB9ASMN1; SMN2PKMTP53
SCHEMBL30641206 0.71 NPC1 (0.42) NPC1RAB9ASMN1; SMN2PKMTP53
SCHEMBL4624975 0.70 NPC1 (0.65) NPC1RAB9ASMN1; SMN2PKMTP53
SCHEMBL15679551 0.70 KMT2A (0.53) NPC1RAB9ASMN1; SMN2PKMTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2523952-B1 OXAZOLE KINASE INHIBITORS AB SCIENCE (FR) 2015-03-04 — — EP disclosed
US-8962665-B2 Thiazole and oxazole kinase inhibitors AB SCIENCE (FR) 2015-02-24 — — US disclosed
US-20130035331-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS AB SCIENCE (FR) 2013-02-07 — — US disclosed
CN-102812022-A Thiazole and oxazole kinase inhibitors AB SCIENCE 2012-12-05 — — CN disclosed
EP-2523952-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS AB Science (FR) 2012-11-21 — — EP disclosed
WO-2011086085-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS AB SCIENCE (FR) 2011-07-21 — — 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-20130035331-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS SYK, LTK, MERTK NPC1 4526/4885RAB9A 4453/4885SMN1; SMN2 3846/4885

“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.

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