SCHEMBL18336649

SCHEMBL18336649

Cc1nc2sc(Br)nn2c(=O)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ENPP3 O14638 1/20 0.38
ENPP1 P22413 1/20 0.38
TDP1 Q9NUW8 3/20 0.36
HTT P42858 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
RECQL P46063 1/20 0.35
TP53 P04637 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PKM P14618 3/20 0.35
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
PLK1 P53350 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
SCHEMBL18336760 0.82 NPC1 (0.47) NPC1RAB9AMAPTSMN1; SMN2ENPP3
SCHEMBL18337205 0.79 AADAT (0.36) NPC1RAB9AMAPTSMN1; SMN2TDP1
SCHEMBL18337277 0.79 AADAT (0.43) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL18336817 0.77 AADAT (0.43) NPC1RAB9AMAPTSMN1; SMN2ENPP3
SCHEMBL11005264 0.74 SMN1; SMN2 (0.71) NPC1RAB9AMAPTSMN1; SMN2ENPP3
SCHEMBL454168 0.71 NPC1 (0.36) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL2440905 0.69 CYP1A2 (0.45) CYP1A2MAPTSMN1; SMN2HTTKDM4E
SCHEMBL18335942 0.68 AADAT (0.45) CYP1A2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL2445247 0.67 CA12 (0.39) NPC1RAB9AMAPTSMN1; SMN2ENPP3
SCHEMBL25263609 0.64 KDM4E (0.47) CYP1A2NPC1RAB9AMAPTSMN1; SMN2

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-3683222-B1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2021-10-06 EP disclosed
EP-3683222-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2020-07-22 EP disclosed
US-10065972-B2 Bicyclic or tricyclic heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2018-09-04 US disclosed
EP-3135674-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2017-03-01 EP disclosed
US-20160376289-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-12-29 US disclosed
US-20160376289-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-12-29 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 (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-20160376289-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND CBR3, CBR1, CYCS CYP1A2 474/4885NPC1 2170/4885RAB9A 2731/4885
US-10065972-B2 Bicyclic or tricyclic heterocyclic compound CBR3, CBR1, CYCS CYP1A2 493/4885NPC1 2168/4885RAB9A 2958/4885

“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.