SCHEMBL10340323

SCHEMBL10340323

CC(NC(=O)[C@@H]1CSCN1C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.48
HPGD P15428 2/20 0.43
GAA P10253 1/20 0.43
LMNA P02545 1/20 0.43
KCNQ3 O43525 1/20 0.43
KCNQ2 O43526 1/20 0.43
GPR139 Q6DWJ6 2/20 0.42
TP53 P04637 1/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PKM P14618 1/20 0.41
KDM4E B2RXH2 1/20 0.40
EPHX1 P07099 2/20 0.40
PIK3CD O00329 1/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL30090978 1.00 RECQL (0.48) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340422 1.00 RECQL (0.48) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340331 1.00 RECQL (0.48) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340322 1.00 RECQL (0.48) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340448 1.00 RECQL (0.48) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340454 1.00 RECQL (0.48) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340330 1.00 RECQL (0.48) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340502 0.93 RECQL (0.41) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340658 0.93 RECQL (0.44) RECQLHPGDGAALMNAKCNQ3
SCHEMBL10340500 0.93 RECQL (0.41) RECQLHPGDGAALMNAKCNQ3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4904680-A IMMUNOLOGY SANKYO COMPANY, LIMITED (JP) 1990-02-27 US claimed
EP-0173441-B1 AMINO ACID DERIVATIVES HAVING ANTI-TUMOR ACTIVITY AND COMPOSITIONS CONTAINING THEM SANKYO COMPANY LIMITED (JP) 1990-01-24 EP claimed
EP-0173441-A1 Amino acid derivatives having anti-tumor activity and compositions containing them SANKYO COMPANY LIMITED (JP) 1986-03-05 EP claimed
US-4904680-A IMMUNOLOGY SANKYO COMPANY, LIMITED (JP) 1990-02-27 US disclosed
EP-0173441-B1 AMINO ACID DERIVATIVES HAVING ANTI-TUMOR ACTIVITY AND COMPOSITIONS CONTAINING THEM SANKYO COMPANY LIMITED (JP) 1990-01-24 EP disclosed
EP-0173441-A1 Amino acid derivatives having anti-tumor activity and compositions containing them SANKYO COMPANY LIMITED (JP) 1986-03-05 EP disclosed