SCHEMBL7349463

SCHEMBL7349463

O=CCCC1CCCCN1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
CYP2D6 P10635 3/20 0.46
MEN1 O00255 2/20 0.46
LMNA P02545 2/20 0.46
TP53 P04637 2/20 0.46
CYP1A2 P05177 2/20 0.46
HTR1A P08908 2/20 0.46
HTR2A P28223 2/20 0.46
KCNH2 Q12809 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
MLNR O43193 1/20 0.46
ABCB11 O95342 1/20 0.46
EGFR P00533 1/20 0.46
FYN P06241 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
ADRA2A P08913 1/20 0.46
ADORA3 P0DMS8 1/20 0.46

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
SCHEMBL6416529 0.94
SCHEMBL6050249 0.86 HRH3 (0.42) KMT2ACYP2D6MEN1LMNATP53
SCHEMBL27311491 0.82
SCHEMBL21556543 0.79 CYP2D6 (0.46) KMT2ACYP2D6MEN1LMNATP53
SCHEMBL6903897 0.78
SCHEMBL15594561 0.78
SCHEMBL5062322 0.78 CYP2D6 (0.44) KMT2ACYP2D6MEN1LMNATP53
SCHEMBL6413011 0.76 KMT2A (0.41) KMT2ACYP2D6MEN1LMNATP53
SCHEMBL3637981 0.76
SCHEMBL272549 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5891464-A REDUCES HAIR LOSS AND PROMOTES HAIR GROWTH. LVMH RECHERCHE (FR) 1999-04-06 US claimed
US-5510113-A PROMOTING HAIR PIGMENTATION LVMH RECHERCHE (FR) 1996-04-23 US claimed
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
CN-1046529-A Carbostyril derivative OTSUKA PHARMA CO LTD (JP) 1990-10-31 CN disclosed