SCHEMBL8814073

SCHEMBL8814073

CCOC(=O)C(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.78
▸ MLNR O43193 1/20 0.78
▸ NR1I2 O75469 1/20 0.78
▸ EGFR P00533 1/20 0.78
▸ LMNA P02545 1/20 0.78
▸ ERBB2 P04626 1/20 0.78
▸ FYN P06241 1/20 0.78
▸ CHRM2 P08172 1/20 0.78
▸ CHRM4 P08173 1/20 0.78
▸ ABCB1 P08183 1/20 0.78
▸ ADRB1 P08588 1/20 0.78
▸ HTR1A P08908 1/20 0.78
▸ CHRM5 P08912 1/20 0.78
▸ ADRA2A P08913 1/20 0.78
▸ ADORA3 P0DMS8 1/20 0.78
▸ CHRM1 P11229 1/20 0.78
▸ ADRB3 P13945 1/20 0.78
▸ DRD2 P14416 1/20 0.78
▸ ADRA2B P18089 1/20 0.78
▸ ADRA2C P18825 1/20 0.78

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
Fumaric Acid SCHEMBL10764614 0.96 NPC1 (0.72) NPC1MLNRNR1I2EGFRLMNA
SCHEMBL6101514 0.91 ADRA1D (0.81) NPC1MLNRNR1I2EGFRLMNA
SCHEMBL28837720 0.91 ADRA1D (0.72) NPC1MLNRNR1I2EGFRLMNA
Carebastine SCHEMBL18538 0.90 LMNA (0.85) NPC1MLNRNR1I2EGFRLMNA
SCHEMBL28837719 0.90 ADRA1D (0.73) NPC1MLNRNR1I2EGFRLMNA
SCHEMBL28837710 0.89 ADRA1D (0.78) NPC1MLNRNR1I2EGFRLMNA
SCHEMBL28837707 0.89 ADRA1D (0.78) NPC1MLNRNR1I2EGFRLMNA
SCHEMBL28837716 0.89 NPC1 (0.69) NPC1MLNRNR1I2EGFRLMNA
SCHEMBL28837725 0.88 NPC1 (0.71) NPC1MLNRNR1I2EGFRLMNA
Ebastine SCHEMBL18467 0.88 ADRA1D (1.00) NPC1MLNRNR1I2EGFRLMNA

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
WO-1997009983-A1 PIPERIDINE DERIVATIVES AND PROCESSES FOR THEIR PRODUCTION ALBANY MOLECULAR RESEARCH, INC. (US) 1997-03-20 — — WO disclosed
EP-0134124-B1 PIPERIDINE DERIVATIVES FORDONAL, S.A. (ES) 1987-10-28 — — EP disclosed
US-4550116-A ANTIALLERGENS, CARDIOVASCULAR AND RESPIRATORY DISORDERS FORDONAL, S.A. (ES) 1985-10-29 — — US disclosed
EP-0134124-A1 Piperidine derivatives FORDONAL, S.A. (ES) 1985-03-13 — — EP disclosed
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