SCHEMBL8445855

SCHEMBL8445855

CCc1ccc(C(C)NCCCn2ccnc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 6/20 0.57
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.51
CYP19A1 P11511 2/20 0.44
TBXAS1 P24557 1/20 0.43
CYP17A1 P05093 1/20 0.43
SOD1 P00441 1/20 0.43

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
SCHEMBL8443891 0.86 HMOX1 (0.53) QPCTLMNAPOLBCYP19A1
SCHEMBL8445916 0.86 QPCT (0.54) QPCTLMNAPOLB
SCHEMBL8444551 0.86 CYP19A1 (0.57) QPCTLMNAPOLBCYP19A1
Hydrochloric Acid SCHEMBL8444444 0.85 QPCT (0.53) QPCTLMNAPOLB
SCHEMBL8444353 0.84 POLB (0.56) QPCTLMNAPOLBCYP19A1SOD1
SCHEMBL8447325 0.84 QPCT (0.58) QPCTLMNAPOLBCYP19A1TBXAS1
SCHEMBL8446799 0.83 SMN1; SMN2 (0.59) QPCTLMNAPOLB
SCHEMBL8949381 0.82 NOS1 (0.55) QPCTLMNAPOLB
SCHEMBL8949474 0.82 LMNA (0.47) QPCTLMNAPOLB
SCHEMBL8443995 0.82 TP53 (0.52) QPCTLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618907-B1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS BRITISH TECH GROUP INT (GB) 1999-04-28 EP disclosed
CN-1037511-C Therapeutic agents BOOTS CO PLC (GB) 1998-02-25 CN disclosed
US-5547972-A 1-(ARLALKYLAMINOALKYL) IMIDAZOLE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1996-08-20 US disclosed
WO-1995022327-A1 USE OF 1-(ARYLALKYLAMINOALKYL) IMIDAZOLES FOR TREATING NEUROLOGICAL DAMAGE KNOLL AG (DE) 1995-08-24 WO disclosed
CN-1096781-A The therapeutical agent that contains 1-(aralkyl-aminoalkyl) imidazolium compounds BOOTS CO PLC (GB) 1994-12-28 CN disclosed
WO-1993013075-A1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS THE BOOTS COMPANY PLC (GB) 1993-07-08 WO disclosed