SCHEMBL12793025

SCHEMBL12793025

C=Cc1cccc(CN2C(=O)c3cccc4cccc(c34)C2=O)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.64
▸ KDM4E B2RXH2 7/20 0.56
▸ UBE2N P61088 3/20 0.56
▸ ATM Q13315 2/20 0.56
▸ CYP1B1 Q16678 2/20 0.55
▸ TDP1 Q9NUW8 1/20 0.53
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ MAPT P10636 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ GAA P10253 2/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ CLTC Q00610 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ HEXA P06865 3/20 0.47
▸ HEXB P07686 3/20 0.47
▸ HPGD P15428 2/20 0.46

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
SCHEMBL17146225 0.88 KMT2A (0.56) NPSR1KDM4EATMCA12CA1
SCHEMBL23591529 0.86 KDM4E (0.66) NPSR1KDM4EUBE2NATMCYP1B1
SCHEMBL12793010 0.86 NPSR1 (0.68) NPSR1KDM4EUBE2NATMCYP1B1
SCHEMBL5594225 0.79 NPSR1 (1.00) NPSR1KDM4EUBE2NATMCYP1B1
SCHEMBL28737148 0.78 UBE2N (0.82) NPSR1KDM4EUBE2NATMCYP1B1
SCHEMBL18500086 0.75 KDM4E (0.69) NPSR1KDM4ECYP1B1CA12CA1
SCHEMBL1201560 0.75 KMT2A (0.57) NPSR1KDM4ECA12CA1CA2
SCHEMBL18500032 0.74 CASP3 (0.55) KDM4ECYP1B1TDP1CA1CA2
SCHEMBL18500085 0.74 ALDH1A1 (0.52) NPSR1KDM4ECYP1B1TDP1CA12
SCHEMBL17146224 0.72 NPSR1 (0.49) NPSR1KDM4ECA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2058375-B1 Pigment composition, water-based pigment dispersion, method of producing water-based pigment dispersion, water-based ink for ink jet recording, and polymer compound FUJIFILM CORP (JP) 2015-08-19 — — EP disclosed
US-8511811-B2 Ink composition, ink set and image forming method FUJIFILM CORPORATION (JP) 2013-08-20 — — US disclosed
US-8511811-B2 Ink composition, ink set and image forming method FUJIFILM CORPORATION (JP) 2013-08-20 — — US disclosed
EP-2295505-A1 Ink composition, ink set and image forming method Fujifilm Corporation (JP) 2011-03-16 — — EP disclosed
US-20110057985-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-10 — — US disclosed
US-20110057985-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-10 — — US disclosed
US-20090131577-A1 PIGMENT COMPOSITION, WATER-BASED PIGMENT DISPERSION, METHOD OF PRODUCING WATER-BASED PIGMENT DISPERSION, WATER-BASED INK FOR INK JET RECORDING, AND POLYMER COMPOUND FUJIFILM CORPORATION (JP) 2009-05-21 — — US disclosed
US-20090131577-A1 PIGMENT COMPOSITION, WATER-BASED PIGMENT DISPERSION, METHOD OF PRODUCING WATER-BASED PIGMENT DISPERSION, WATER-BASED INK FOR INK JET RECORDING, AND POLYMER COMPOUND FUJIFILM CORPORATION (JP) 2009-05-21 — — US disclosed
EP-2058375-A2 Pigment composition, water-based pigment dispersion, method of producing water-based pigment dispersion, water-based ink for ink jet recording, and polymer compound FUJIFILM Corporation (JP) 2009-05-13 — — EP disclosed
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