SCHEMBL16238646

SCHEMBL16238646

Nc1c(O)c(Cl)cc(Cl)c1C(=O)NCC1CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ HTR4 Q13639 1/20 0.41
▸ DRD2 P14416 5/20 0.41
▸ DRD3 P35462 5/20 0.41
▸ CHRM1 P11229 3/20 0.41
▸ DRD1 P21728 3/20 0.41
▸ DRD4 P21917 3/20 0.41
▸ DRD5 P21918 3/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ MAPK14 Q16539 1/20 0.40
▸ BCL2 P10415 1/20 0.40
▸ BCL2L1 Q07817 1/20 0.40
▸ MCL1 Q07820 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
SCHEMBL3467921 0.79 POLB (0.42) NPC1RAB9ADRD2DRD3CHRM1
SCHEMBL3241274 0.78 HPGD (0.45) NPC1RAB9AKMT2AKDM4EMAPK14
SCHEMBL4937899 0.77 POLB (0.47) NPC1RAB9ADRD2DRD3DRD1
SCHEMBL14734915 0.72 CNR2 (0.49) NPC1RAB9AHTR4CHRM1KMT2A
SCHEMBL4217851 0.72 NPC1 (0.51) NPC1RAB9AHTR4CHRM1KMT2A
SCHEMBL31565734 0.70 P2RX7 (0.59) NPC1RAB9AHTR4CHRM1KMT2A
SCHEMBL3243585 0.69 THRB (0.43) NPC1DRD3CHRM1DRD1CYP1A2
SCHEMBL612129 0.69 TTR (0.48) KMT2AKDM4EHSD17B10CYP3A4MAPK1
SCHEMBL13474695 0.69 NTRK1 (0.46) KMT2AHSD17B10ALDH1A1MEN1
Hydrochloric Acid SCHEMBL8155815 0.68 TTR (0.47) KMT2AKDM4EHSD17B10CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2379510-B1 QUINAZOLINONE COMPOUNDS PRANA BIOTECHNOLOGY LTD (AU) 2016-10-26 — — EP disclosed
US-9145375-B2 Quinazolinone compounds PRANA BIOTECHNOLOGY LIMITED (AU) 2015-09-29 — — US disclosed
US-20150025072-A1 QUINAZOLINONE COMPOUNDS PRANA BIOTECHNOLOGY LIMITED (AU) 2015-01-22 — — US disclosed
US-8889695-B2 Quinazolinone compounds PRANA BIOTECHNOLOGY LIMITED (AU) 2014-11-18 — — 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 (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-20150025072-A1 QUINAZOLINONE COMPOUNDS PARK7, SNCA, NQO2 NPC1 1143/4885RAB9A 88/4885HTR4 497/4885

“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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