SCHEMBL11246032

SCHEMBL11246032

CC1CCN(CCCCOc2ccccc2CCc2ccc(Cl)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 10/20 0.60
▸ ALDH1A1 P00352 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ SIGMAR1 Q99720 3/20 0.56
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ ABCB1 P08183 2/20 0.52

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
SCHEMBL11251231 0.90 ALDH1A1 (0.60) HRH3ALDH1A1LMNASIGMAR1MEN1
SCHEMBL11255661 0.87 ALDH1A1 (0.62) HRH3ALDH1A1LMNAMEN1KMT2A
SCHEMBL11253990 0.87 L3MBTL1 (0.61) HRH3ALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL11253964 0.87 SIGMAR1 (0.61) HRH3ALDH1A1LMNASIGMAR1MEN1
SCHEMBL11255822 0.87 KDM4E (0.59) HRH3ALDH1A1LMNASIGMAR1MEN1
SCHEMBL11257123 0.86 L3MBTL1 (0.60) HRH3ALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL11260526 0.85 KDM4E (0.50) HRH3ALDH1A1MEN1KMT2AKDM4E
SCHEMBL11258366 0.84 HRH3 (0.50) HRH3ALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL11264264 0.84 ABCB1 (0.53) ALDH1A1KDM4EABCB1
SCHEMBL11248417 0.79 ABCB1 (0.55) SIGMAR1MEN1KMT2AKDM4EABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4323568-A INHIBIT PLATELET AGGREGATION MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1982-04-06 — — US disclosed
EP-0001759-B1 (OMEGA-AMINOALKOXY) BIBENZYLS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE SUBSTANCES MITSUBISHI KASEI CORPORATION (JP) 1981-12-30 — — EP disclosed
US-4220603-A ANTICOAGULANTS MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1980-09-02 — — US disclosed
EP-0001759-A1 (Omega-aminoalkoxy) bibenzyls, processes for their preparation and pharmaceutical compositions containing these substances MITSUBISHI KASEI CORPORATION (JP) 1979-05-16 — — EP disclosed
Send feedback