SCHEMBL11045882

SCHEMBL11045882

Cc1ccc(Cc2c[nH]cn2)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.36
PYCR1 P32322 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
P2RX7 Q99572 1/20 0.32
MAPT P10636 3/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.32
RAB9A P51151 2/20 0.31
KMT2A Q03164 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
NPC1 O15118 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
GAA P10253 2/20 0.31

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
SCHEMBL10405987 0.87 GAA (0.42) TNFKDM4EALDH1A1MAPTLMNA
SCHEMBL10737553 0.85 TNF (0.35) TNFPYCR1KDM4EALDH1A1P2RX7
SCHEMBL10737423 0.83 TNF (0.34) TNFPYCR1KDM4EALDH1A1P2RX7
SCHEMBL6972728 0.79 ALDH1A1 (0.42) ALDH1A1P2RX7LMNAKMT2ASMN1; SMN2
SCHEMBL10406697 0.77 HTR1D (0.41) MAPTKMT2AHTR1DHTR1BMEN1
SCHEMBL10742584 0.75 TAAR1 (0.47) KDM4EALDH1A1MAPTLMNATP53
SCHEMBL6972732 0.75 NOTUM (0.39) ALDH1A1RAB9ANPC1HTT
SCHEMBL11045854 0.73 DAO (0.42) LMNA
Detomidine SCHEMBL7087060 0.73 ALDH1A1 (0.35) ALDH1A1P2RX7TP53KMT2ASLC6A2
Detomidine SCHEMBL247340 0.73 ALDH1A1 (0.35) ALDH1A1P2RX7TP53KMT2ASLC6A2

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-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-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