SCHEMBL8664976

SCHEMBL8664976

C=COCCCCCN(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
TSHR P16473 1/20 0.50
DNM1 Q05193 3/20 0.42
KDM4E B2RXH2 3/20 0.38
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
CDC25A P30304 1/20 0.33
HTR1B P28222 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
LSS P48449 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32

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
SCHEMBL3059214 1.00 ALDH1A1 (0.50) ALDH1A1TSHRDNM1KDM4EMAOA
SCHEMBL8661838 1.00 ALDH1A1 (0.50) ALDH1A1TSHRDNM1KDM4EMAOA
SCHEMBL329227 0.98 ALDH1A1 (0.46) ALDH1A1TSHRDNM1KDM4EMAOA
SCHEMBL329408 0.91
SCHEMBL136974 0.80
SCHEMBL18675767 0.80 ALDH1A1 (0.38) ALDH1A1TSHRCDC25A
SCHEMBL9644644 0.80 ALDH1A1 (0.38) ALDH1A1TSHRCDC25A
SCHEMBL9646107 0.80 ALDH1A1 (0.38) ALDH1A1TSHRCDC25A
SCHEMBL22408792 0.80 ALDH1A1 (0.38) ALDH1A1TSHRCDC25A
SCHEMBL1538336 0.80 ALDH1A1 (0.38) ALDH1A1TSHRCDC25A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0458479-B1 Pigment dispersing agent NIPPON OILS & FATS CO LTD (JP) 1998-11-25 EP disclosed
US-5244979-A Paints NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1993-09-14 US disclosed
EP-0458479-A2 Pigment dispersing agent NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-11-27 EP disclosed