SCHEMBL27520895

SCHEMBL27520895

CC1(c2ccccc2)CN(c2ccc(Cl)cc2)CCN1CCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 3/20 0.46
▸ HTR7 P34969 2/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ LMNA P02545 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MMP2 P08253 1/20 0.42
▸ MMP13 P45452 1/20 0.42
▸ ADAMTS5 Q9UNA0 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NR1H2 P55055 2/20 0.41
▸ NR1H3 Q13133 2/20 0.41
▸ CACNA1G O43497 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ DRD2 P14416 3/20 0.39
▸ DRD4 P21917 3/20 0.39
▸ DRD5 P21918 1/20 0.39

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
SCHEMBL4428542 0.76 ALDH1A1 (0.38) HTR1AHTR7MEN1KMT2ALMNA
SCHEMBL4416262 0.76 HTR1A (0.38) HTR1AHTR7MEN1KMT2AMAPT
SCHEMBL4423588 0.75 ESR1 (0.42) HTR1AHTR7MEN1KMT2AMAPT
SCHEMBL4417230 0.75 HTR1A (0.38) HTR1AHTR7MAPTLMNAMMP2
SCHEMBL4425309 0.73 HTR1A (0.42) HTR1AHTR7MEN1KMT2AMAPT
SCHEMBL4417265 0.73 MEN1 (0.43) HTR1AHTR7MEN1KMT2AMAPT
SCHEMBL3301404 0.71 MALT1 (0.44) ALDH1A1
SCHEMBL4430300 0.71 HTR1A (0.41) HTR1AHTR7MEN1KMT2AMAPT
SCHEMBL4417932 0.71 ESR1 (0.47) HTR1AHTR7MEN1KMT2AMAPT
SCHEMBL5009446 0.71 HTR1A (0.72) HTR1AHTR7KMT2AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1246323-C Nitrogen-based camptothecin derivatives CALIFORNIA PACIFIC MED CENTER (US) 2006-03-22 — — CN disclosed
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