SCHEMBL10725112

SCHEMBL10725112

Cc1nccn1CCCCCCCCc1ccc(C(=O)CCC(=O)O)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ ALDH1A1 P00352 4/20 0.48
▸ LMNA P02545 1/20 0.48
▸ PRNP P04156 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ KMT2A Q03164 2/20 0.40
▸ GART P22102 2/20 0.40
▸ ATIC P31939 2/20 0.40
▸ SHMT1 P34896 2/20 0.40
▸ SHMT2 P34897 2/20 0.40
▸ HPGD P15428 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ ALPL P05186 2/20 0.37
▸ ALPG P10696 2/20 0.37
▸ ALPI P09923 1/20 0.37

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
SCHEMBL10724644 1.00 POLB (0.52) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10725085 1.00 POLB (0.52) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10730500 1.00 POLB (0.52) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10724408 0.99 POLB (0.50) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10729567 0.96 POLB (0.48) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10727088 0.91 POLB (0.44) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10724414 0.84 POLB (0.40) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10992470 0.78 TBXAS1 (0.56) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10984374 0.78 TBXAS1 (0.56) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL10993498 0.78 TBXAS1 (0.56) POLBTDP1ALDH1A1LMNAPRNP

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
US-4643998-A Imidazolylalkylthienyl tetrahydropyridazines and processes for their use A. NATTERMAN & CIE GMBH (DE) 1987-02-17 — — US disclosed
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