SCHEMBL7873631

SCHEMBL7873631

C=CCn1c(C#N)nc2ccc(Cl)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 7/20 0.40
HPGD P15428 7/20 0.40
KDM4E B2RXH2 7/20 0.40
GAA P10253 5/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 3/20 0.39
TP53 P04637 1/20 0.39
PPARG P37231 1/20 0.39
HTT P42858 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL13677300 0.76 GAA (0.47) MEN1KMT2AALDH1A1HPGDGAA
SCHEMBL13676921 0.75 ACSS2 (0.47) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL8520151 0.75 ACSS2 (0.44) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL7038026 0.69 HPGD (0.41) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20919761 0.67 DRD2 (0.52) LMNASMN1; SMN2TSHRPOLB
SCHEMBL204001 0.66 KMO (0.55) MEN1KMT2AALDH1A1HPGDGAA
SCHEMBL9074842 0.65 SMN1; SMN2 (0.42) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL31738429 0.65 LMNA (0.56) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL13677244 0.65 GAA (0.47) MEN1KMT2AALDH1A1HPGDGAA
SCHEMBL30617060 0.64 KDM4E (0.55) MEN1KMT2AALDH1A1HPGDKDM4E

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-6329135-B1 LIGHT INSENSITIVE ORGANIC SILVER SALT ON A SUPPORT KONICA CORPORATION (JP) 2001-12-11 US disclosed
EP-1058151-A1 Silver halide photothermographic material KONICA CORPORATION (JP) 2000-12-06 EP disclosed
US-5922529-A MATERIAL HAVING PHOTOSENSITIVE LAYER CONTAINING MERCAPTAN COMPOUND AND MEROCYANINE DYE; IMPROVED SHARPNESS, SENSITIVITY, AGING STABILITY FUJI PHOTO FILM CO., LTD. (JP) 1999-07-13 US disclosed