SCHEMBL20565989

SCHEMBL20565989

Clc1cccc(-c2nc(-c3cccc(Cl)c3)nc(-c3cccc(Br)c3)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 2/20 0.47
TSHR P16473 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
IDO1 P14902 3/20 0.47
NR1I3 Q14994 1/20 0.45
AHR P35869 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
CYP19A1 P11511 1/20 0.44
DHPS P49366 1/20 0.44
AVPR1A P37288 1/20 0.43
METAP2 P50579 1/20 0.43
IDH1 O75874 1/20 0.43
KDM1A O60341 1/20 0.43

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
SCHEMBL30558017 1.00 NPC1 (0.47) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL29666525 0.95 NPC1 (0.51) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL28368325 0.95 NPC1 (0.51) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL19845767 0.91 CYP19A1 (0.48) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL18566526 0.91 CYP19A1 (0.48) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL29878444 0.88 RAB9A (0.56) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4547022 0.88 RAB9A (0.56) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL10589866 0.88 IDO1 (0.57) NPC1RAB9ATSHRSMN1; SMN2ALDH1A1
SCHEMBL18982872 0.87 MEN1 (0.53) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL15809380 0.86 RAB9A (0.49) NPC1RAB9AMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4194442-A1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER Novaled GmbH (DE) 2023-06-14 EP disclosed
EP-4194442-A1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER Novaled GmbH (DE) 2023-06-14 EP disclosed
EP-3406599-B1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER NOVALED GMBH (DE) 2023-02-22 EP disclosed
EP-3406599-B1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER NOVALED GMBH (DE) 2023-02-22 EP disclosed
US-11502258-B2 Organic electronic device comprising an organic semiconductor layer NOVALED GMBH (DE) 2022-11-15 US disclosed
US-20200161559-A1 Organic Electronic Device Comprising an Organic Semiconductor Layer NOVALED GMBH (DE) 2020-05-21 US disclosed
US-20200161559-A1 Organic Electronic Device Comprising an Organic Semiconductor Layer NOVALED GMBH (DE) 2020-05-21 US disclosed
WO-2018215348-A1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER NOVALED GMBH (DE) 2018-11-29 WO disclosed
EP-3406599-A1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER Novaled GmbH (DE) 2018-11-28 EP 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-20200161559-A1 Organic Electronic Device Comprising an Organic Semiconductor Layer C1S, YAP1, ESR1 NPC1 1989/4885RAB9A 3954/4885MEN1 715/4885
US-11502258-B2 Organic electronic device comprising an organic semiconductor layer C1S, YAP1, ESR1 NPC1 1989/4885RAB9A 3954/4885MEN1 715/4885

“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.