SCHEMBL3465338

SCHEMBL3465338

Clc1ccnc2c(Br)n[nH]c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 1/20 0.38
▸ CHEK1 O14757 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ PLK3 Q9H4B4 1/20 0.35
▸ KDM4E B2RXH2 4/20 0.33
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ TDP1 Q9NUW8 4/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ MMP14 P50281 3/20 0.33
▸ LMNA P02545 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ HTT P42858 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ TP53 P04637 2/20 0.33
▸ HSP90AA1 P07900 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ ALOX12 P18054 2/20 0.33
▸ SLC6A2 P23975 2/20 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
SCHEMBL25257294 0.77 CHEK1 (0.39) DAOCHEK1FLT3PLK3KDM4E
SCHEMBL30423773 0.77 CHEK1 (0.39) DAOCHEK1FLT3PLK3KDM4E
SCHEMBL28380264 0.71 MAPK1 (0.48) DAOKDM4EMEN1KMT2ATDP1
SCHEMBL30424722 0.69 LRRK2 (0.41) DAOCHEK1AXLPRKCI
SCHEMBL15799693 0.69 LRRK2 (0.41) DAOCHEK1AXLPRKCI
SCHEMBL6851931 0.67 MAPT (0.40) KDM4EALDH1A1LMNAMAPTHTT
SCHEMBL29361454 0.67 CHEK1 (0.63) DAOCHEK1FLT3PLK3CYP1A2
SCHEMBL7014902 0.66 NR4A2 (0.48) DAOKDM4EMEN1KMT2ATDP1
SCHEMBL14906033 0.64 MAPK1 (0.45) MAPK1
SCHEMBL30548007 0.64 HTR2A (0.35) CHEK1FLT3PLK3CYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12522598-B2 3-(2-(heteroaryl)-pyridin-4-yl)-5-(trifluoromethyl)-1,2,4-oxadiazole derivatives as HDAC6 inhibitors ORYZON GENOMICS SA (ES) 2026-01-13 — — US disclosed
CN-114206868-B 3- (2- (Heteroaryl) -pyridin-4-yl) -5- (trifluoromethyl) -1,2, 4-oxadiazole derivatives as HDAC6 inhibitors 奥莱松基因组股份有限公司 2025-02-25 — — CN disclosed
US-20220298156-A1 3-(2-(HETEROARYL)-PYRIDIN-4-YL)-5-(TRIFLUOROMETHYL)-1,2,4-OXADIAZOLE DERIVATIVES AS HDAC6 INHIBITORS ORYZON GENOMICS SA (ES) 2022-09-22 — — US disclosed
CN-114206868-A 3- (2- (heteroaryl) -pyridin-4-yl) -5- (trifluoromethyl) -1,2, 4-oxadiazole derivatives as HDAC6 inhibitors 奥莱松基因组股份有限公司 2022-03-18 — — CN disclosed
WO-2020245381-A1 3-(2-(HETEROARYL)-PYRIDIN-4-YL)-5-(TRIFLUOROMETHYL)-1,2,4-OXADIAZOLE DERIVATIVES AS HDAC6 INHIBITORS ORYZON GENOMICS, S.A. (ES) 2020-12-10 — — WO disclosed
US-7652035-B2 CRF receptor antagonists and methods relating thereto Neurocrine Bioscience, Inc. (US) 2010-01-26 — — US disclosed
EP-1802621-B1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO SMITHKLINE BEECHAM CORK LTD (IE) 2009-05-06 — — EP disclosed
US-20080064719-A1 Crf Receptor Antagonists And Methods Relating Thereto SMITHKLINE BEECHAM (CORK) LIMITED (IE) 2008-03-13 — — US disclosed
EP-1802621-A1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO SB Pharmco Puerto Rico Inc. (PR) 2007-07-04 — — EP disclosed
WO-2006044821-A1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO SB PHARMCO PUERTO RICO INC. (PR) 2006-04-27 — — 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 (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-20080064719-A1 Crf Receptor Antagonists And Methods Relating Thereto CRHR1, CRHR2, SCTR DAO 673/4885CHEK1 4302/4885FLT3 3091/4885
US-20220298156-A1 3-(2-(HETEROARYL)-PYRIDIN-4-YL)-5-(TRIFLUOROMETHYL)-1,2,4-OXADIAZOLE DERIVATIVES AS HDAC6 INHIBITORS HDAC6, HDAC1, HDAC3 DAO 3781/4885CHEK1 2418/4885FLT3 1555/4885

“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.

Send feedback