SCHEMBL8300733

SCHEMBL8300733

COc1cc(CNC(=O)c2cc(Cl)ccc2N)ccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.55
HPGD P15428 3/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
DNMT3A Q9Y6K1 1/20 0.49
APEX1 P27695 1/20 0.48
KDM4E B2RXH2 1/20 0.48
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
NLRP3 Q96P20 1/20 0.47
AKR1B1 P15121 1/20 0.47
PPARA Q07869 1/20 0.47

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
SCHEMBL8292287 0.91 GAA (0.57) LMNAHPGDCA1CA2DNMT3A
SCHEMBL7655088 0.84 TP53 (0.55) LMNAHPGDCA1CA2KDM4E
SCHEMBL8292510 0.83 AKR1B1 (0.51) LMNAHPGDDNMT3AKDM4EUSP2
SCHEMBL17241767 0.81 GAA (0.57) LMNAHPGDDNMT3AAPEX1KDM4E
SCHEMBL8299247 0.80 PDE5A (0.53) LMNAHPGDAKR1B1
SCHEMBL6944281 0.79 GAA (0.55) LMNAHPGDAPEX1KDM4EUSP2
SCHEMBL8301468 0.79 POLB (0.51) LMNAHPGDCA1CA2APEX1
SCHEMBL6940100 0.79 MEN1 (0.52) LMNAAKR1B1
SCHEMBL23535641 0.79 KMT2A (0.53) LMNAHPGDCA1CA2KDM4E
SCHEMBL11445600 0.79 LMNA (0.63) LMNAHPGDDNMT3AAPEX1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686625-B1 ANTHRANILIC ACID DERIVATIVE EISAI CO LTD (JP) 1999-05-26 EP disclosed
US-5716993-A PHOSPHODIESTERASE ENZYME INHIBITOR FOR TREATING CARDIOVASCULAR DISORDER, ANGINA PECTORIS, HYPERTENSION, ASTHMA EISAI CO., LTD. (JP) 1998-02-10 US disclosed
CN-1118595-A Anthranilic acid derivative EISAI CO LTD (JP) 1996-03-13 CN disclosed
EP-0686625-A1 ANTHRANILIC ACID DERIVATIVE Eisai Co., Ltd. (JP) 1995-12-13 EP disclosed