SCHEMBL8301665

SCHEMBL8301665

COc1ccc(CNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
LMNA P02545 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
KDM4E B2RXH2 2/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
ALDH1A1 P00352 5/20 0.48
HPGD P15428 2/20 0.47
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL8301375 0.87 NLRP3 (0.53) LMNAGAAHPGD
SCHEMBL8292287 0.83 GAA (0.57) LMNAKDM4EGAAALDH1A1HPGD
SCHEMBL8299247 0.81 PDE5A (0.53) NPC1LMNAGAAHPGDMEN1
SCHEMBL6944281 0.81 GAA (0.55) LMNASMN1; SMN2KDM4EGAAALDH1A1
SCHEMBL8301784 0.80 POLB (0.46) NPC1LMNASMN1; SMN2KDM4EPOLB
SCHEMBL8301788 0.80 POLB (0.46) NPC1LMNASMN1; SMN2KDM4EPOLB
SCHEMBL8299255 0.78 PDE5A (0.53) LMNAGAAHPGD
SCHEMBL24254492 0.77 NPC1 (0.61) NPC1LMNASMN1; SMN2KDM4EGAA
SCHEMBL8297189 0.77 GAA (0.55) LMNAGAAHPGDMEN1KMT2A
SCHEMBL17241767 0.76 GAA (0.57) LMNAKDM4EGAAALDH1A1HPGD

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