SCHEMBL6965256

SCHEMBL6965256

BrCCOC1c2ccccc2CSc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
ALDH1A1 P00352 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
HPGD P15428 1/20 0.47
ALOX12 P18054 1/20 0.47
GAA P10253 3/20 0.46
POLB P06746 1/20 0.41
KMT2A Q03164 4/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP2C19 P33261 1/20 0.36
RCE1 Q9Y256 2/20 0.35
MEN1 O00255 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
RAD52 P43351 1/20 0.35
LMNA P02545 2/20 0.33
TBXA2R P21731 1/20 0.33
RET P07949 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
KCNA3 P22001 1/20 0.31
ADRA2A P08913 2/20 0.30

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
SCHEMBL6716119 0.85 GAA (0.49) MAPTALDH1A1TDP1HPGDALOX12
SCHEMBL8715328 0.80 RET (0.44) RETHTR2ACYP2D6
SCHEMBL19330047 0.72 ALDH1A1 (0.54) MAPTALDH1A1TDP1HPGDALOX12
SCHEMBL6160581 0.70 ALDH1A1 (0.49) MAPTALDH1A1TDP1HPGDALOX12
SCHEMBL5466833 0.70 ALDH1A1 (0.57) MAPTALDH1A1TDP1HPGDALOX12
SCHEMBL2126069 0.70 ALDH1A1 (0.60) MAPTALDH1A1TDP1HPGDALOX12
SCHEMBL8162584 0.69 ALDH1A1 (0.44) MAPTALDH1A1TDP1CYP2C19LMNA
SCHEMBL14997683 0.69 ALDH1A1 (0.55) MAPTALDH1A1TDP1HPGDALOX12
SCHEMBL8938392 0.69 ALDH1A1 (0.44) MAPTALDH1A1TDP1HPGDALOX12
SCHEMBL10239427 0.68 ALDH1A1 (0.55) MAPTALDH1A1TDP1HPGDALOX12

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-0934312-B1 1,4-DISUBSTITUTED PIPERAZINES NOVO NORDISK AS (DK) 2003-03-19 EP disclosed
US-6133268-A 1,4-disubstituted piperazines NOVO NORDISK A/S (DK) 2000-10-17 US disclosed
US-6040302-A ANTIINFLAMMATORY AGENTS TREATING RHEUMATOID ARTHRITIS, MIGRAINE OR ITCHING, INSULIN RESISTANCE IN NON-INSULIN-DEPENDENT DIABETES MELLITUS AND AGEING-ASSOCIATED OBESITY NOVO NORDISK A/S (DK) 2000-03-21 US disclosed
US-6004961-A ANTIINFLAMMATORY AGENTS, ANALGESICS; NON-INSULIN-DEPENDENT DIABETES; AGE-RELATED OBESITY; DIBENZO(D,G)(1,3,6)DIOXAZOCINE DERIVATIVES NOVO NORDISK A/S (DK) 1999-12-21 US disclosed
EP-0934312-A1 1,4-DISUBSTITUTED PIPERAZINES NOVO NORDISK A/S (DK) 1999-08-11 EP disclosed
WO-1998015548-A1 1,4-DISUBSTITUTED PIPERAZINES NOVO NORDISK A/S (DK) 1998-04-16 WO disclosed