SCHEMBL11162874

SCHEMBL11162874

COc1cc(NC(C)=O)ccc1COCCCN1CCN(c2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 2/20 0.55
▸ HTR7 P34969 2/20 0.53
▸ TP53 P04637 2/20 0.52
▸ MAPT P10636 2/20 0.50
▸ HTR2A P28223 2/20 0.50
▸ USP2 O75604 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ HTR4 Q13639 1/20 0.48
▸ HTR1A P08908 2/20 0.48
▸ GFER P55789 1/20 0.47
▸ KMT2A Q03164 1/20 0.46
▸ HTR1D P28221 1/20 0.46
▸ HTR1B P28222 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
SCHEMBL11165829 0.86 DRD2 (0.62) DRD2HTR7TP53MAPTHTR2A
SCHEMBL11169527 0.83 DRD2 (0.58) DRD2HTR7TP53MAPTUSP2
SCHEMBL11161262 0.83 HTR2A (0.56) DRD2HTR7MAPTHTR2AHTR1A
SCHEMBL11169258 0.83 DRD2 (0.57) DRD2HTR7TP53MAPTUSP2
SCHEMBL11167712 0.81 MCHR1 (0.63) DRD2HTR7TP53MAPTUSP2
SCHEMBL11160725 0.78 ALDH1A1 (0.55) DRD2TP53MAPTUSP2ALDH1A1
SCHEMBL11173613 0.78 MCHR1 (0.66) DRD2TP53MAPTUSP2ALDH1A1
SCHEMBL11168272 0.78 DRD2 (0.56) DRD2MAPTHTR2AUSP2ALDH1A1
SCHEMBL11198528 0.78 ALDH1A1 (0.60) TP53MAPTUSP2ALDH1A1LMNA
SCHEMBL11159508 0.77 MAPT (0.55) TP53MAPTUSP2ALDH1A1LMNA

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
EP-0034752-B1 PHENOXYALKANE DERIVATIVE AND PROCESSES FOR PREPARING SAME Tanabe Seiyaku Co., Ltd. (JP) 1983-06-08 — — EP claimed
EP-0034752-A1 Phenoxyalkane derivative and processes for preparing same Tanabe Seiyaku Co., Ltd. (JP) 1981-09-02 — — EP claimed
EP-0034752-B1 PHENOXYALKANE DERIVATIVE AND PROCESSES FOR PREPARING SAME Tanabe Seiyaku Co., Ltd. (JP) 1983-06-08 — — EP disclosed
EP-0034752-A1 Phenoxyalkane derivative and processes for preparing same Tanabe Seiyaku Co., Ltd. (JP) 1981-09-02 — — EP disclosed
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