SCHEMBL304909

SCHEMBL304909

O=[N+]([O-])c1c(Cl)ncnc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA13 Q8N1Q1 1/20 0.49
ALDH1A1 P00352 4/20 0.44
TSHR P16473 2/20 0.44
CUL4A Q13619 1/20 0.44
LMNA P02545 5/20 0.41
HTT P42858 4/20 0.41
ADORA3 P0DMS8 1/20 0.37
MAPT P10636 5/20 0.37
KDM4E B2RXH2 2/20 0.37
MITF O75030 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
XBP1 P17861 1/20 0.35
RAB9A P51151 1/20 0.35
TLR9 Q9NR96 1/20 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
SCHEMBL788257 0.85 HTT (0.54) CA1CA2CA7CA13ALDH1A1
SCHEMBL16071245 0.85 CA1 (0.43) CA1CA2CA7CA13ALDH1A1
SCHEMBL7245419 0.85 CA1 (0.43) CA1CA2CA7CA13ALDH1A1
SCHEMBL14437603 0.80 CA1 (0.40) CA1CA2CA7CA13ALDH1A1
SCHEMBL8756900 0.80 CA1 (0.40) CA1CA2CA7CA13ALDH1A1
SCHEMBL8078419 0.80 LMNA (0.40) CA1CA2CA7CA13ALDH1A1
SCHEMBL6658994 0.80 CA1 (0.43) CA1CA2CA7CA13ALDH1A1
SCHEMBL2786861 0.80 CA1 (0.44) CA1CA2CA7CA13ALDH1A1
SCHEMBL788318 0.80 CA1 (0.54) CA1CA2CA7CA13ALDH1A1
SCHEMBL18269124 0.80 CA1 (0.54) CA1CA2CA7CA13ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115626897-A Preparation method of 5-amino-4, 6-diisopropyl pyrimidine 常州佳德医药科技有限公司 2023-01-20 CN claimed
US-6176909-B1 IN POLYMERIC BINDER XEROX CORPORATION 2001-01-23 US claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
EP-0320370-B1 4,6-Di-(3-amine-5-nitro-1,2,4-triazol)-5-nitropyrimidine derivative, process for its preparation and explosive material containing it COMMISSARIAT ENERGIE ATOMIQUE (FR) 1993-11-10 EP claimed
EP-0128563-B1 IMPROVED ANTIFOGGANT PROCESS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-04-04 EP claimed
EP-0045570-B1 USE OF ORGANIC HALOGEN COMPOUNDS TO REDUCE OR PREVENT FOG IN NEGATIVE-WORKING SILVER HALIDE EMULSIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-09-28 EP claimed
US-4323645-A Organic halogen compounds for negative-working silver halide emulsions E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-04-06 US claimed
EP-0045570-A1 Use of organic halogen compounds to reduce or prevent fog in negative-working silver halide emulsions E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-02-10 EP claimed
US-4119460-A FUSED CARBOCYCLIC RING COMPOUNDS, POLYPHENYL COMPOUNDS NITROGEN-FREE POLYARYLATED COMPOUNDS EASTMAN KODAK COMPANY (US) 1978-10-10 US claimed
JP-63316795-A None JP disclosed
EP-3912979-B1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC (US) 2026-03-25 EP disclosed
EP-3858833-B9 AMINONORBORNANE DERIVATIVE AND MANUFACTURE METHOD THEREOF AND USE THEREOF TRANSTHERA SCIENCES NANJING INC (CN) 2026-03-11 EP disclosed
EP-4689155-A1 USE OF INHIBITORS TO INCREASE EFFICIENCY OF CRISPR/CAS INSERTIONS Astrazeneca AB (SE) 2026-02-11 EP disclosed
US-4153695-A VIRICIDES ELI LILLY AND COMPANY (US) 1979-05-08 US disclosed
US-4119460-A FUSED CARBOCYCLIC RING COMPOUNDS, POLYPHENYL COMPOUNDS NITROGEN-FREE POLYARYLATED COMPOUNDS EASTMAN KODAK COMPANY (US) 1978-10-10 US disclosed
US-4055411-A 5-NITRO-PYRIMIDINES CIBA-GEIGY CORPORATION (US) 1977-10-25 US disclosed
US-4014677-A HERBICIDES CIBA-GEIGY CORPORATION (US) 1977-03-29 US disclosed
US-3948914-A PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1976-04-06 US disclosed