SCHEMBL14744092

SCHEMBL14744092

C=C(C(=O)O)c1ccccc1SC#N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.41
▸ LMNA P02545 2/20 0.37
▸ CA12 O43570 2/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA4 P22748 2/20 0.37
▸ CA7 P43166 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ MAPT P10636 4/20 0.35
▸ HPGD P15428 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ RAB9A P51151 1/20 0.33
▸ GAA P10253 3/20 0.33
▸ KMT2A Q03164 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32

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
SCHEMBL440880 0.83 POLB (0.61) POLBCA12CA1CA2CA4
SCHEMBL28780147 0.79 AKR1C3 (0.50) POLBALDH1A1MAPTHSP90AA1RAB9A
SCHEMBL10869194 0.78 SIRT1 (0.55) POLBLMNASIRT1ALDH1A1MAPT
SCHEMBL5960318 0.78 ALDH1A1 (0.44) POLBLMNACA12CA1CA2
SCHEMBL18813000 0.76 SIRT1 (0.62) POLBLMNACA12CA1CA2
SCHEMBL11123891 0.76 ALDH1A1 (0.52) POLBCA12CA1CA2CA4
SCHEMBL11093857 0.75 LMNA (0.65) POLBLMNACA1CA2CA9
SCHEMBL3009389 0.74 LMNA (0.42) POLBLMNAALDH1A1ALOX15MAPT
SCHEMBL1463325 0.74 CYP1A2 (0.46) LMNACYP1A2ALDH1A1ALOX15MAPT
SCHEMBL11440098 0.74 POLB (0.42) POLBLMNAALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140246094-A1 ASYMMETRIC CYANINE DYES FOR PHOTOVOLTAIC APPLICATIONS PIANETA S.R.L. (IT) 2014-09-04 — — US disclosed
EP-2748264-A1 ASYMMETRIC CYANINE DYES FOR PHOTOVOLTAIC APPLICATIONS Pianeta S.r.l. (IT) 2014-07-02 — — EP disclosed
WO-2013030737-A1 ASYMMETRIC CYANINE DYES FOR PHOTOVOLTAIC APPLICATIONS PIANETA S.R.L. (IT) 2013-03-07 — — WO disclosed
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