SCHEMBL9819950

SCHEMBL9819950

CCOC(=O)N1CCN(CCC(C)c2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
KDM4E B2RXH2 4/20 0.62
TSHR P16473 1/20 0.61
GAA P10253 1/20 0.60
MAPT P10636 1/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL10730870 0.87 ALDH1A1 (0.73) ALDH1A1KDM4ETSHRGAA
SCHEMBL27320487 0.85 KDM4E (0.52) ALDH1A1KDM4EPOLB
SCHEMBL10737014 0.82 KDM4E (0.62) ALDH1A1KDM4ETSHRGAA
SCHEMBL10730867 0.80 HRH2 (0.61) ALDH1A1KDM4ETSHRGAA
SCHEMBL13687245 0.79 SMN1; SMN2 (0.55) ALDH1A1KDM4E
SCHEMBL10640352 0.78 ALDH1A1 (0.95) ALDH1A1KDM4ETSHRGAAMAPT
SCHEMBL13995623 0.78 HRH2 (0.51) ALDH1A1KDM4ETSHRMAPTPOLB
SCHEMBL13995270 0.76 MEN1 (0.56) ALDH1A1TSHRPOLB
SCHEMBL28578060 0.76 MEN1 (0.56) ALDH1A1KDM4EPOLB
SCHEMBL13150327 0.75 ALDH1A1 (0.57) ALDH1A1KDM4ETSHRGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4987132-A PLATELET ACTIVATING FACTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-01-22 US disclosed
EP-0279681-A2 Saturated heterocyclic carboxamide derivatives YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-08-24 EP disclosed