SCHEMBL22926672

SCHEMBL22926672

O=C(Nc1ccc(Br)cc1)Nc1cccnc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 6/20 0.74
RAB9A P51151 7/20 0.71
NPC1 O15118 6/20 0.71
MEN1 O00255 5/20 0.71
KMT2A Q03164 5/20 0.71
CYP11B1 P15538 1/20 0.69
CYP11B2 P19099 1/20 0.69
KDM4E B2RXH2 2/20 0.66
MAPK1 P28482 1/20 0.66
HTT P42858 1/20 0.66
MAOA P21397 1/20 0.66
MAOB P27338 1/20 0.66
MAPT P10636 2/20 0.61
PKM P14618 2/20 0.61
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.60
CASP3 P42574 1/20 0.59
SENP8 Q96LD8 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59

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
SCHEMBL29517932 1.00 FPR2 (0.74) FPR2RAB9ANPC1MEN1KMT2A
SCHEMBL9637653 0.88 MEN1 (0.77) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL30051982 0.88 MEN1 (0.77) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL10665495 0.86 RAB9A (0.79) RAB9ANPC1MEN1KMT2AKDM4E
Bromide SCHEMBL29417998 0.86 MEN1 (0.74) RAB9ANPC1MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL29388210 0.86 MEN1 (0.74) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL9190799 0.84 TAAR1 (0.68) FPR2RAB9ANPC1MEN1KMT2A
SCHEMBL7849600 0.83 RAB9A (0.71) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL19932355 0.83 RAB9A (0.71) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL5853939 0.83 RAB9A (1.00) RAB9ANPC1MEN1KMT2AKDM4E

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
WO-2023172669-A2 COMBINATION THERAPIES FOR MODULATION OF LIPID PRODUCTION OHIO STATE INNOVATION FOUNDATION (US) 2023-09-14 WO claimed
CN-110437140-A It is a kind of inhibit SREBP-1 target spot compound and its application CHINESE PLA GENERAL HOSPITAL 2019-11-12 CN claimed
CN-114025763-B Adenosine compound, pharmaceutically acceptable salt or stereoisomer thereof and application 中国人民解放军军事科学院军事医学研究院 2023-09-12 CN disclosed
US-20220332750-A1 ADENOSINE COMPOUND, ITS PHARMACEUTICALLY ACCEPTABLE SALT OR ITS STEREOISOMER AND USE THEREOF ACADEMY OF MILITARY MEDICAL SCIENCES (CN) 2022-10-20 US disclosed
EP-3988100-A1 ADENOSINE COMPOUND, PHARMACEUTICALLY ACCEPTABLE SALT OR STEREOISOMERIDE THEREOF, AND USE Academy Of Military Medical Sciences (CN) 2022-04-27 EP disclosed
CN-114025763-A Adenosine compound, pharmaceutically acceptable salt or stereoisomer thereof and application 中国人民解放军军事科学院军事医学研究院 2022-02-08 CN disclosed
CN-110437140-B Compound for inhibiting SREBP-1 target and application thereof 中国人民解放军总医院 2021-08-03 CN disclosed
US-20210022340-A1 USE OF PYRIDINE UREA COMPOUND HAVING SNAIL-KILLING ACTIVITY THE NATIONAL INSTITUTE OF PARASITIC DISEASES, CHINESE CENTER FOR DISEASE CONTROL AND PREVENTION (CN) 2021-01-28 US disclosed
CN-110437140-A It is a kind of inhibit SREBP-1 target spot compound and its application CHINESE PLA GENERAL HOSPITAL 2019-11-12 CN 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-20210022340-A1 USE OF PYRIDINE UREA COMPOUND HAVING SNAIL-KILLING ACTIVITY SLC14A1, UACA, UROD FPR2 3331/4885RAB9A 1093/4885NPC1 1905/4885
US-20220332750-A1 ADENOSINE COMPOUND, ITS PHARMACEUTICALLY ACCEPTABLE SALT OR ITS STEREOISOMER AND USE THEREOF ADORA2A, ADORA3, ADORA1 FPR2 1505/4885RAB9A 1381/4885NPC1 413/4885

“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.