SCHEMBL9768934

SCHEMBL9768934

[CH2]CCCCc1ccc(CC)s1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
PRNP P04156 1/20 0.34
RECQL P46063 1/20 0.34
RXFP1 Q9HBX9 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
SCHEMBL18067908 0.83 ALDH1A1 (0.38) ALDH1A1LMNARECQL
SCHEMBL19513763 0.81 ESR1 (0.41) ALDH1A1LMNA
SCHEMBL17192984 0.81 ESR1 (0.41) ALDH1A1LMNA
SCHEMBL16405008 0.81 ESR1 (0.41) ALDH1A1LMNA
SCHEMBL3503770 0.80 MAPT (0.42) POLBALDH1A1RECQL
SCHEMBL18067900 0.79 ALDH1A1 (0.42) TDP1ALDH1A1
SCHEMBL18067920 0.78 POLB (0.38) POLBTDP1
SCHEMBL18067914 0.77 POLB (0.37) POLBTDP1ALDH1A1LMNAPRNP
SCHEMBL45854 0.76
SCHEMBL16563787 0.76 TAAR1 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4992534-A Anticarcinogenic agents with better water solubility, low toxicity, absorption and stability OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-12 US disclosed
EP-0303269-A2 2'-Deoxy-5-fluorouridine derivatives, process for preparing the same and the use thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-02-15 EP disclosed