SCHEMBL393852

SCHEMBL393852

Nc1nc(Cl)ccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 3/20 0.50
GABRD O14764 3/20 0.50
GABRA1 P14867 3/20 0.50
GABRB1 P18505 3/20 0.50
GABRG2 P18507 3/20 0.50
GABRB3 P28472 3/20 0.50
GABRA5 P31644 3/20 0.50
GABRA3 P34903 3/20 0.50
GABRA2 P47869 3/20 0.50
GABRB2 P47870 3/20 0.50
GABRA4 P48169 3/20 0.50
GABRE P78334 3/20 0.50
GABRA6 Q16445 3/20 0.50
GABRG1 Q8N1C3 3/20 0.50
GABRG3 Q99928 3/20 0.50
GABRQ Q9UN88 3/20 0.50
NAPRT Q6XQN6 2/20 0.47
CYP1A2 P05177 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TSHR P16473 2/20 0.41

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
SCHEMBL631872 0.98 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL30664846 0.83 IKBKB (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL392559 0.83 IKBKB (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL920297 0.83 GABRP (0.64) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31139883 0.82 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL20657822 0.82 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
Hydrochloric Acid SCHEMBL921022 0.81 GABRP (0.62) GABRPGABRDGABRA1GABRB1GABRG2
Lithium Ion SCHEMBL631871 0.80 KDM4E (0.39) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL56617 0.78 SMN1; SMN2 (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29378242 0.78 SMN1; SMN2 (0.50) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119841817-B Aromatic ester compound containing benzo five-membered ring, and preparation method and application thereof 山东省联合农药工业有限公司 2026-05-12 CN disclosed
US-20250382288-A1 8-AZA QUINAZOLINES AS BRAIN-PENETRANT SOS1-INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2025-12-18 US disclosed
US-20250332173-A1 COMPOUNDS AND METHODS FOR MODULATING NUCLEIC ACID SPLICING REMIX THERAPEUTICS INC (US) 2025-10-30 US disclosed
US-20250282776-A1 Bicyclic TLR7 Agonists and Uses Thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2025-09-11 US disclosed
EP-4574816-A1 HETEROCYCLIC COMPOUND CAPABLE OF INHIBITING PRMT5 - MTA AND USE THEREOF Xizang Haisco Pharmaceutical Co., Ltd. (CN) 2025-06-25 EP disclosed
CN-116265462-B Heterocyclic compound with antitumor activity and application thereof 石药集团中奇制药技术(石家庄)有限公司 2025-05-16 CN disclosed
CN-119841817-A Aromatic ester compound containing benzo five-membered ring, and preparation method and application thereof 山东省联合农药工业有限公司 2025-04-18 CN disclosed
WO-2025067457-A1 HETEROCYCLIC FUSED RING COMPOUND, AND COMPOSITION AND USE THEREOF 深圳市塔吉瑞生物医药有限公司 2025-04-03 WO disclosed
CN-119546582-A Heterocyclic compound capable of inhibiting PRMT5.MTA and application thereof 西藏海思科制药有限公司 2025-02-28 CN disclosed
US-20250051330-A1 HETEROCYCLIC COMPOUND HAVING ANTI-TUMOR ACTIVITY AND USE THEREOF CSPC ZHONGQI PHARMACEUTICAL TECHNOLOGY (SHIJIAZHUANG) CO., LTD (CN) 2025-02-13 US disclosed
US-20070082913-A1 Substituted heterocyclic compounds with CXCR3 antagonist activity SCHERING CORPORATION 2007-04-12 US disclosed
EP-1771420-A1 NOVEL 2,6-DIAMINOPYRIDINE-3-ONE DERIVATIVES F. Hoffmann-Roche AG (CH) 2007-04-11 EP disclosed
EP-1669348-A1 NOVEL ANTIFUNGAL AGENT COMPRISING HETEROCYCLIC COMPOUND Eisai Co., Ltd. (JP) 2006-06-14 EP disclosed
US-20060014708-A1 2,6-Diaminopyridine derivatives BARTKOVITZ DAVID J 2006-01-19 US disclosed
WO-2006005548-A1 NOVEL 2,6-DIAMINOPYRIDINE-3-ONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2006-01-19 WO disclosed
US-6831175-B2 Such as N,N-dimethyl-N-(2-((5-((E)-2-pyridin-4-ylvinyl) pyridin-3-yl)oxy)ethyl)amine ABBOTT LABORATORIES 2004-12-14 US disclosed
EP-1463505-A2 3-(PHENYL-ALKOXY)-5-(PHENYL)-PYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Abbott Laboratories (US) 2004-10-06 EP disclosed
US-20030199511-A1 Kinase inhibitors ABBVIE INC. 2003-10-23 US disclosed
US-20030187026-A1 Kinase inhibitors ABBOTT LABORATORIES 2003-10-02 US disclosed
WO-2003051366-A2 3-(PHENYL-ALKOXY)-5-(PHENYL)-PYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER ABBOTT LABORATORIES (US) 2003-06-26 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 (8 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-20070082913-A1 Substituted heterocyclic compounds with CXCR3 antagonist activity CXCR3, CXCL10, CXCR1 GABRP 3251/4885GABRD 2784/4885GABRA1 2572/4885
US-20030187026-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K1 GABRP 3663/4885GABRD 4139/4885GABRA1 3929/4885
US-20250332173-A1 COMPOUNDS AND METHODS FOR MODULATING NUCLEIC ACID SPLICING SNRPA, NSUN2, SNRPA1 GABRP 1661/4885GABRD 1546/4885GABRA1 2363/4885
US-20250282776-A1 Bicyclic TLR7 Agonists and Uses Thereof TLR7, TLR9, TLR1 GABRP 652/4885GABRD 795/4885GABRA1 473/4885
US-20060014708-A1 2,6-Diaminopyridine derivatives CDK2, CCNA2, CDK6 GABRP 4595/4885GABRD 3908/4885GABRA1 4738/4885
US-20030199511-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K1 GABRP 3663/4885GABRD 4139/4885GABRA1 3929/4885
US-20250382288-A1 8-AZA QUINAZOLINES AS BRAIN-PENETRANT SOS1-INHIBITORS SOS1, SOS2, SOST GABRP 3559/4885GABRD 3250/4885GABRA1 1692/4885
US-20250051330-A1 HETEROCYCLIC COMPOUND HAVING ANTI-TUMOR ACTIVITY AND USE THEREOF SOS1, HINT1, WNT1 GABRP 3951/4885GABRD 4063/4885GABRA1 2463/4885

“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.