SCHEMBL341567

SCHEMBL341567

CC(=O)c1ccc2cccc(Br)c2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.50
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
PIM1 P11309 1/20 0.45
AR P10275 1/20 0.41
MMP2 P08253 2/20 0.41
IRAK4 Q9NWZ3 1/20 0.40
PARP1 P09874 1/20 0.37
MEN1 O00255 1/20 0.36
PSMD14 O00487 1/20 0.36
NPC1 O15118 1/20 0.36
PKM P14618 1/20 0.36
AGTR1 P30556 1/20 0.36
OPRK1 P41145 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HDAC8 Q9BY41 2/20 0.35

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
SCHEMBL1723184 0.84 KDM4E (0.66) BACE1KMT2AKDM4EPIM1MMP2
SCHEMBL18463763 0.82 BACE1 (0.50) BACE1KMT2AKDM4EPIM1AR
SCHEMBL1726223 0.81 MAPT (0.49) BACE1KMT2AKDM4EPIM1MMP2
SCHEMBL16654015 0.81 BACE1 (0.46) BACE1KMT2AKDM4EPIM1AR
SCHEMBL29496137 0.81 BACE1 (0.46) BACE1KMT2AKDM4EPIM1AR
SCHEMBL6112866 0.80 PARP1 (0.49) KMT2AKDM4EPIM1MMP2PARP1
SCHEMBL1051386 0.80 KDM4E (0.71) KMT2AKDM4EPIM1MMP2MEN1
SCHEMBL6594652 0.79 BACE1 (0.47) BACE1KMT2AKDM4EPIM1AR
SCHEMBL4459171 0.79 KDM4E (0.46) KMT2AKDM4EPIM1MMP2PARP1
SCHEMBL28932903 0.79 PARP1 (0.47) KMT2AKDM4EPIM1MMP2PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12221409-B2 Method for preparing chiral alkyl compounds by asymmetric hydrogenation of olefins catalyzed by iron complex ZHEJIANG UNIVERSITY (CN) 2025-02-11 US disclosed
US-20240174588-A1 METHOD FOR PREPARING CHIRAL ALKYL COMPOUNDS BY ASYMMETRIC HYDROGENATION OF OLEFINS CATALYZED BY IRON COMPLEX ZHEJIANG UNIVERSITY (CN) 2024-05-30 US disclosed
CN-111747891-B SNN ligand based on quinoline skeleton, iron complex thereof, preparation method and application 中国科学院上海有机化学研究所 2022-08-09 CN disclosed
CN-111747891-A SNN ligand based on quinoline skeleton, iron complex thereof, preparation method and application 中国科学院上海有机化学研究所 2020-10-09 CN disclosed
US-9394297-B2 Amides as pim inhibitors AMGEN INC. (US) 2016-07-19 US disclosed
US-20150329538-A1 AMIDES AS PIM INHIBITORS AMGEN INC. (US) 2015-11-19 US disclosed
US-20130023634-A1 CATALYST SYSTEM BASED ON QUINOLINE DONORS EQUISTAR CHEMICALS, LP 2013-01-24 US disclosed
US-20130023634-A1 CATALYST SYSTEM BASED ON QUINOLINE DONORS EQUISTAR CHEMICALS, LP 2013-01-24 US disclosed
US-20120016092-A1 Catalysts based on quinoline precursors BASELL POLYOLEFINE GMBH (DE) 2012-01-19 US disclosed
US-20120016092-A1 Catalysts based on quinoline precursors BASELL POLYOLEFINE GMBH (DE) 2012-01-19 US disclosed
WO-2012009369-A1 CATALYSTS BASED ON QUINOLINE PRECURSORS BASELL POLYOLEFINE GMBG (DE) 2012-01-19 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 (3 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-20240174588-A1 METHOD FOR PREPARING CHIRAL ALKYL COMPOUNDS BY ASYMMETRIC HYDROGENATION OF OLEFINS CATALYZED BY IRON COMPLEX SFXN1, SFXN3, HMOX2 BACE1 1341/4885KMT2A 1242/4885KDM4E 2674/4885
US-20150329538-A1 AMIDES AS PIM INHIBITORS PIM1, PIM3, PIM2 BACE1 2404/4885KMT2A 424/4885KDM4E 267/4885
US-12221409-B2 Method for preparing chiral alkyl compounds by asymmetric hydrogenation of olefins catalyzed by iron complex SFXN1, SFXN3, HMOX2 BACE1 1341/4885KMT2A 1242/4885KDM4E 2674/4885

“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.