SCHEMBL56989

SCHEMBL56989

COC(=O)c1c(Cl)ccnc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.46
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 4/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 2/20 0.43
HPGD P15428 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
POLB P06746 2/20 0.41
ALOX15 P16050 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TYK2 P29597 2/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
KDM6B O15054 1/20 0.40
KDM5C P41229 1/20 0.40

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
SCHEMBL30227922 1.00 ATR (0.46) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL15454465 0.85 ALDH1A1 (0.43) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL25652299 0.84 ATR (0.36) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL31254527 0.84 ATR (0.55) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL15231394 0.84 ATR (0.55) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL1563063 0.84 ATR (0.44) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL27373972 0.84 CA12 (0.46) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL4231441 0.82 ALDH1A1 (0.41) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL3342272 0.82 ALDH1A1 (0.41) ATRALDH1A1KDM4ETSHRHSD17B10
SCHEMBL3828695 0.82 ALDH1A1 (0.41) ATRALDH1A1KDM4ETSHRHSD17B10

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 108 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688753-A1 KCC2 POTENTIATORS AND USES THEREOF Axonis Therapeutics, Inc. (US) 2026-02-11 EP disclosed
EP-4688754-A1 KCC2 POTENTIATORS AND USES THEREOF Axonis Therapeutics, Inc. (US) 2026-02-11 EP disclosed
US-20260028327-A1 KCC2 POTENTIATORS AND USES THEREOF AXONIS THERAPEUTICS, INC. 2026-01-29 US disclosed
US-20260028351-A1 KCC2 POTENTIATORS AND USES THEREOF AXONIS THERAPEUTICS, INC. 2026-01-29 US disclosed
US-20250382304-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS NUVALENT INC (US) 2025-12-18 US disclosed
US-20250381182-A1 ALDH-2 INHIBITOR COMPOUNDS AND METHODS OF USE AMYGDALA NEUROSCIENCES, INC. (US) 2025-12-18 US disclosed
US-12351569-B2 ALDH-2 inhibitor compounds and methods of use AMYGDALA NEUROSCIENCES, INC. (US) 2025-07-08 US disclosed
EP-4540237-A1 ALDH-2 INHIBITOR COMPOUNDS AND METHODS OF USE Amygdala Neurosciences, Inc. (US) 2025-04-23 EP disclosed
US-12275742-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents NUVALENT, INC. (US) 2025-04-15 US disclosed
WO-2024211686-A1 KCC2 POTENTIATORS AND USES THEREOF AXONIS THERAPEUTICS, INC. (US) 2024-10-10 WO disclosed
WO-2008041118-A2 PYRIDO[4,3-D]PYRIMIDIN-4(3H)-ONE DERIVATIVES AS CALCIUM RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-04-10 WO disclosed
WO-2008041118-A2 PYRIDO[4,3-D]PYRIMIDIN-4(3H)-ONE DERIVATIVES AS CALCIUM RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-04-10 WO disclosed
CN-101146793-A Novel heterocyclic substituted pyridine or phenyl compounds with CXCR3 antagonist activity SCHERING CORP (US) 2008-03-19 CN disclosed
CN-101128441-A Fused aromatic compounds having anti-diabetic activity MERCK & CO INC (US) 2008-02-20 CN disclosed
WO-2007077005-A1 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2007-07-12 WO disclosed
CN-1874769-A Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC (US) 2006-12-06 CN disclosed
CN-1585746-A Inhibitors of beta-amyloid production and secretion DAIICHI SEIYAKU CO (JP) 2005-02-23 CN disclosed
US-20040220403-A1 1-(2-Methoxybenzyl)-3-benzhydrylpiperazines as tachykinin anatgonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-04 US disclosed
EP-1368343-A1 1-(2-METHOXYBENZYL)-3-BENZHYDRYLPIPERAZINES AS TACHYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-10 EP disclosed
WO-2002055518-A1 1-(2-METHOXYBENZYL)-3-BENZHYDRYLPIPERAZINES AS TACHYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-18 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 (7 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-20260028327-A1 KCC2 POTENTIATORS AND USES THEREOF HCN1, KCNC1, HCN2 ATR 3293/4885ALDH1A1 3655/4885KDM4E 3406/4885
US-20260028351-A1 KCC2 POTENTIATORS AND USES THEREOF GRIN2C, HCN1, KCNC1 ATR 3303/4885ALDH1A1 3779/4885KDM4E 3650/4885
US-12275742-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents CYP2C8, ABCB1, PAICS ATR 2791/4885ALDH1A1 1313/4885KDM4E 1381/4885
US-20250381182-A1 ALDH-2 INHIBITOR COMPOUNDS AND METHODS OF USE ALDH1A1, ALDH2, ALDH3A1 ATR 3104/4885ALDH1A1 1/4885KDM4E 924/4885
US-20250382304-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS CYP2C8, ABCB1, PAICS ATR 2791/4885ALDH1A1 1313/4885KDM4E 1381/4885
US-12351569-B2 ALDH-2 inhibitor compounds and methods of use ALDH1A1, ALDH2, ALDH3A1 ATR 3028/4885ALDH1A1 1/4885KDM4E 970/4885
US-20040220403-A1 1-(2-Methoxybenzyl)-3-benzhydrylpiperazines as tachykinin anatgonists BDKRB1, BDKRB2, TACR1 ATR 4378/4885ALDH1A1 1825/4885KDM4E 3462/4885

“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.