SCHEMBL2693409

SCHEMBL2693409

Cc1ccc(C(=O)c2cc(C)c(C)c(C)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.70
▸ LMNA P02545 2/20 0.70
▸ SRD5A2 P31213 2/20 0.59
▸ HTT P42858 4/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ CNR1 P21554 1/20 0.51
▸ CNR2 P34972 1/20 0.51
▸ CES2 O00748 1/20 0.50
▸ CES1 P23141 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ RAB9A P51151 2/20 0.49
▸ TDP1 Q9NUW8 2/20 0.48
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.48
▸ ABCC3 O15438 1/20 0.47
▸ ABCC4 O15439 1/20 0.47
▸ NR1I2 O75469 1/20 0.47
▸ ABCB11 O95342 1/20 0.47
▸ TTR P02766 1/20 0.47
▸ NR3C1 P04150 1/20 0.47

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
SCHEMBL12362778 0.86 ALDH1A1 (0.84) ALDH1A1LMNASRD5A2HTTSMN1; SMN2
SCHEMBL12399061 0.86 SMN1; SMN2 (0.46) ALDH1A1LMNASRD5A2HTTSMN1; SMN2
SCHEMBL13057523 0.85 ALDH1A1 (0.67) ALDH1A1LMNASRD5A2HTTSMN1; SMN2
SCHEMBL52200 0.83 ALDH1A1 (1.00) ALDH1A1LMNASRD5A2HTTSMN1; SMN2
SCHEMBL822185 0.83 ALDH1A1 (1.00) ALDH1A1LMNASRD5A2HTTSMN1; SMN2
SCHEMBL9323609 0.83 ALDH1A1 (0.61) ALDH1A1SRD5A2SMN1; SMN2CNR1CNR2
SCHEMBL29530464 0.83 SMN1; SMN2 (0.74) ALDH1A1LMNASRD5A2HTTSMN1; SMN2
SCHEMBL12554042 0.83 SMN1; SMN2 (0.74) ALDH1A1LMNASRD5A2HTTSMN1; SMN2
SCHEMBL2622768 0.83 SMN1; SMN2 (0.74) ALDH1A1LMNASRD5A2HTTSMN1; SMN2
SCHEMBL13057624 0.82 ALDH1A1 (0.55) ALDH1A1LMNASRD5A2HTTSMN1; SMN2

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-8088882-B2 Polymer precursor, high transparency polyimide precursor, polymer compound, resin composition and article using thereof DAI NIPPON PRINTING CO., LTD. (JP) 2012-01-03 — — US disclosed
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