SCHEMBL599869

SCHEMBL599869

Clc1ccnc2ccc(I)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1B Q9Y463 3/20 0.47
PARP1 P09874 1/20 0.44
CCNC P24863 2/20 0.44
CDK8 P49336 2/20 0.44
NR4A2 P43354 2/20 0.43
GAK O14976 2/20 0.42
RIPK2 O43353 1/20 0.42
COQ8A Q8NI60 1/20 0.42
NLK Q9UBE8 1/20 0.42
AXL P30530 1/20 0.41
PRKCI P41743 1/20 0.41
KDM4E B2RXH2 3/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 2/20 0.39
HPGD P15428 2/20 0.39
ALOX15 P16050 2/20 0.39
MEN1 O00255 2/20 0.39
MAPK1 P28482 2/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL29915158 1.00 DYRK1B (0.47) DYRK1BPARP1CCNCCDK8NR4A2
SCHEMBL1618081 0.84 NR4A2 (0.43) DYRK1BNR4A2GAKAXLPRKCI
SCHEMBL17059461 0.79 PARP1 (0.47) PARP1CCNCCDK8NR4A2GAK
SCHEMBL1888577 0.79 NR4A2 (0.66) DYRK1BPARP1CCNCCDK8NR4A2
SCHEMBL30051309 0.79 NR4A2 (0.66) DYRK1BPARP1CCNCCDK8NR4A2
SCHEMBL20733040 0.76 PARP1 (0.44) DYRK1BPARP1CCNCCDK8NR4A2
SCHEMBL599975 0.76 PARP1 (0.44) PARP1CCNCCDK8NR4A2GAK
SCHEMBL18970831 0.76 PARP1 (0.44) PARP1CCNCCDK8NR4A2GAK
SCHEMBL31355748 0.76 SMN1; SMN2 (0.51) PARP1CCNCCDK8NR4A2GAK
SCHEMBL14075851 0.76 SMN1; SMN2 (0.51) PARP1CCNCCDK8NR4A2GAK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12281080-B2 Quinoline-based compounds and methods of inhibiting CDK8/19 UNIVERSITY OF SOUTH CAROLINA (US) 2025-04-22 US disclosed
US-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 US disclosed
US-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 US disclosed
US-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 US disclosed
US-20240190904-A1 Heteroaryl compounds as inhibitors of RIP2 kinase, composition and application thereof ACCRO BIOSCIENCE (HK) LIMITED (HK) 2024-06-13 US disclosed
EP-4374928-A2 NOVEL ALK2 INHIBITORS AND METHODS FOR INHIBITING BMP SIGNALING The Brigham And Women's Hospital Inc. (US) 2024-05-29 EP disclosed
WO-2024078513-A1 CONDENSED AZINES FOR TREATING CANCER CHENGDU ANTICANCER BIOSCIENCE , LTD. (CN) 2024-04-18 WO disclosed
EP-4330233-A1 PHENYL -O-QUINOLINE, QUINAZOLINE, THIENOPYRIDINE, THIENOPYRIMIDINE, PYRROLOPYRIDINE, PYRROLOPYRIMIDINE COMPOUNDS HAVING ANTICANCER ACTIVITY Chengdu Anticancer Bioscience, Ltd. (CN) 2024-03-06 EP disclosed
EP-4322947-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF RIP2 KINASE, COMPOSITION AND APPLICATION THEREOF Accro Bioscience (HK) Limited (HK) 2024-02-21 EP disclosed
EP-3615538-B1 NOVEL ALK2 INHIBITORS AND METHODS FOR INHIBITING BMP SIGNALING BRIGHAM & WOMENS HOSPITAL INC (US) 2024-02-07 EP disclosed
CN-101023080-A Thiazolinone 4-monosubstituted quinolines HOFFMANN LA ROCHE (CH) 2007-08-22 CN disclosed
US-7253285-B2 Thiazolinone 4-monosubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
US-7253285-B2 Thiazolinone 4-monosubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
US-7253285-B2 Thiazolinone 4-monosubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
EP-1797085-A1 THIAZOLINONE 4-MONOSUBSTITUTED QUINOLINES F. Hoffmann-Roche AG (CH) 2007-06-20 EP disclosed
EP-1699780-A1 NOVEL QUINOLINE DERIVATIVES Pfizer, Inc. (US) 2006-09-13 EP disclosed
US-20060063805-A1 Thiazolinone 4-monosubstituted quinolines CHEN LI 2006-03-23 US disclosed
WO-2006029861-A1 THIAZOLINONE 4-MONOSUBSTITUTED QUINOLINES F. HOFFMANN-LA ROCHE AG (CH) 2006-03-23 WO disclosed
WO-2005063739-A1 NOVEL QUINOLINE DERIVATIVES PFIZER INC. (US) 2005-07-14 WO disclosed
US-20050137395-A1 Novel quinoline derivatives AGOURON PHARMACEUTICALS, INC. 2005-06-23 US 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 (4 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-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CYP27A1, CPT1A, OAT DYRK1B 4403/4885PARP1 3679/4885CCNC 2945/4885
US-20060063805-A1 Thiazolinone 4-monosubstituted quinolines CDK1, CDK14, CDK17 DYRK1B 674/4885PARP1 202/4885CCNC 51/4885
US-12281080-B2 Quinoline-based compounds and methods of inhibiting CDK8/19 CDK8, CDK9, CDK19 DYRK1B 1225/4885PARP1 566/4885CCNC 35/4885
US-20240190904-A1 Heteroaryl compounds as inhibitors of RIP2 kinase, composition and application thereof RIPK2, RIPK1, RIPK3 DYRK1B 2336/4885PARP1 397/4885CCNC 3060/4885

“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.