SCHEMBL7289995

SCHEMBL7289995

OCNCC1CCCCO1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.49
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 1/20 0.46
ANPEP P15144 1/20 0.46
KMT2A Q03164 4/20 0.46
HTT P42858 1/20 0.45
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TP53 P04637 1/20 0.43
ALOX12 P18054 1/20 0.43
MEN1 O00255 1/20 0.42
PKM P14618 1/20 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
SCHEMBL11062839 0.84 HPGD (0.46) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL5864150 0.82 HPGD (0.60) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL27032972 0.81 ALDH1A1 (0.56) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL11064200 0.81 HPGD (0.44) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL611743 0.80 KMT2A (0.53) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL11060437 0.79 HPGD (0.45) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL18873645 0.79 HPGD (0.45) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL8795715 0.78 ANPEP (0.49) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL17376511 0.77 HPGD (0.54) HPGDALDH1A1KDM4ELMNAANPEP
SCHEMBL7957967 0.76 HPGD (0.42) HPGDALDH1A1KDM4ELMNAANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5652247-A VASOPRESSIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD (JP) 1997-07-29 US disclosed
US-5436254-A Vaopressin antagonists OTSUKA PHARMACEUTICAL COMPANY, LTD. (JP) 1995-07-25 US disclosed
EP-0602209-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-22 EP disclosed
EP-0382185-B1 Carbostyril derivatives OTSUKA PHARMA CO LTD (JP) 1994-06-15 EP disclosed
WO-1994001113-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-01-20 WO disclosed
US-5225402-A Vasopressin antagonist, vasodilation, hypotensive, diuretics and anticoagulants OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-06 US disclosed
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed