SCHEMBL9149586

SCHEMBL9149586

Cc1ccccc1CCC(=O)c1ccc(CCCN(C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 8/20 0.54
▸ THRB P10828 8/20 0.54
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CASP3 P42574 1/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44
▸ SENP6 Q9GZR1 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ EGFR P00533 2/20 0.43
▸ DPP4 P27487 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.42
▸ LMNA P02545 1/20 0.41

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
SCHEMBL9725192 0.82 THRA (0.61) THRATHRBNPC1RAB9AKMT2A
SCHEMBL9151866 0.80 THRA (0.66) THRATHRBNPC1RAB9ACASP3
SCHEMBL28128459 0.78 KMT2A (0.55) NPC1RAB9AKMT2ACASP3SENP8
SCHEMBL9154172 0.78 THRA (0.53) THRATHRBNPC1RAB9AKMT2A
SCHEMBL9148552 0.78 THRA (0.59) THRATHRBNPC1RAB9A
SCHEMBL9150875 0.78 THRA (0.59) THRATHRBNPC1RAB9ALMNA
SCHEMBL9151000 0.77 NPC1 (0.64) THRATHRBNPC1RAB9AEGFR
Hydrochloric Acid SCHEMBL9725207 0.77 THRA (0.58) THRATHRBNPC1RAB9ALMNA
SCHEMBL7069304 0.76 SIGMAR1 (0.56) THRATHRBNPC1RAB9ACASP3
SCHEMBL9151826 0.76 THRA (0.57) THRATHRBNPC1RAB9AKMT2A

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-0401798-B1 Substituted aminoalkylbenzene derivatives HOFFMANN LA ROCHE (CH) 1995-01-11 — — EP claimed
EP-0401798-B1 Substituted aminoalkylbenzene derivatives HOFFMANN LA ROCHE (CH) 1995-01-11 — — EP disclosed
US-5137920-A METHOD OF TREATING FUNGAL INFECTIONS HOFFMANN-LA ROCHE INC. (US) 1992-08-11 — — US disclosed
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