SCHEMBL10735375

SCHEMBL10735375

CC1(c2ccc(Oc3ccc(CCl)cc3)cc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.35
KCNH2 Q12809 1/20 0.33
ST14 Q9Y5Y6 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP13 P45452 1/20 0.33
LTA4H P09960 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 1/20 0.30
GRM5 P41594 1/20 0.30

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
SCHEMBL121680 0.89 KCNH2 (0.35) KCNH2GRM5
SCHEMBL8551187 0.78 ST14 (0.48) TTRST14LTA4HALDH1A1
SCHEMBL1338731 0.78 ST14 (0.48) TTRST14LTA4HALDH1A1
SCHEMBL6157954 0.72 LTA4H (0.54) TTRLTA4HALDH1A1SMN1; SMN2
SCHEMBL9505702 0.72 SMN1; SMN2 (0.49) TTRST14LTA4HALDH1A1SMN1; SMN2
SCHEMBL6161837 0.72 TEAD4 (0.52) TTRST14MMP13LTA4HALDH1A1
SCHEMBL2987196 0.70 MAOB (0.54) TTRKCNH2ST14LTA4H
SCHEMBL510124 0.70 LTA4H (0.61) TTRLTA4H
SCHEMBL18571103 0.70 TP53 (0.40) KCNH2ALDH1A1SMN1; SMN2HPGD
SCHEMBL434091 0.70 CA1 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0132606-B1 BENZIMIDAZOLE DERIVATIVES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-07 EP disclosed
US-4663339-A Acaricidal and insecticidal substituted 1-phenylalkylbenzimidazoles SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-05-05 US disclosed
US-4612323-A Insecticidal and acaricidal derivatives of 1-benzylbenzimidazole SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-09-16 US disclosed
EP-0186190-A2 Benzimidazole derivatives, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-07-02 EP disclosed
EP-0132606-A1 Benzimidazole derivatives, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-02-13 EP disclosed