SCHEMBL6972728

SCHEMBL6972728

Cc1ccccc1Cc1c[nH]cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
AR P10275 1/20 0.40
P2RX7 Q99572 1/20 0.39
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
USP2 O75604 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
LTA4H P09960 1/20 0.35
EGFR P00533 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
HTR6 P50406 1/20 0.34

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
Detomidine SCHEMBL247340 0.86 ALDH1A1 (0.35) ALDH1A1HPGDP2RX7TAAR1ADRA2A
Detomidine SCHEMBL7087060 0.86 ALDH1A1 (0.35) ALDH1A1HPGDP2RX7TAAR1ADRA2A
Detomidine SCHEMBL20362222 0.85 ALDH1A1 (0.34) ALDH1A1HPGDP2RX7TAAR1MEN1
Detomidine SCHEMBL28676651 0.85 ALDH1A1 (0.34) ALDH1A1HPGDP2RX7TAAR1MEN1
Detomidine SCHEMBL21618409 0.85 ALDH1A1 (0.34) ALDH1A1HPGDP2RX7TAAR1MEN1
Detomidine SCHEMBL203174 0.85 ALDH1A1 (0.34) ALDH1A1HPGDP2RX7TAAR1ADRA2A
SCHEMBL10741610 0.84 TAAR1 (0.44) ALDH1A1HPGDP2RX7TAAR1ADRA2A
Detomidine SCHEMBL21624996 0.83 SLC6A2 (0.33) ALDH1A1HPGDTAAR1ADRA2AADRA2B
SCHEMBL11047730 0.82 TAAR1 (0.36) ALDH1A1TAAR1MEN1KMT2ALMNA
SCHEMBL10740026 0.81 TAAR1 (0.42) ALDH1A1HPGDP2RX7TAAR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP claimed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US claimed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP claimed
EP-0954521-B1 4- (THIEN-3-YL)METHYL] IMIDAZOLE DERIVATIVES HAVING ALPHA2-ADRENOCEPTOR AGONISTIC ACTIVITY ORTHO MCNEIL PHARM INC (US) 2003-05-14 EP disclosed
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP disclosed