SCHEMBL6416569

SCHEMBL6416569

[c]1c(Sc2cccc3ccccc23)ccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IFNAR1 P17181 1/20 0.41
ALDH1A1 P00352 6/20 0.41
LMNA P02545 3/20 0.41
MAPK1 P28482 2/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
HSD17B10 Q99714 3/20 0.38
CYP2A6 P11509 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.36
RAD52 P43351 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HPRT1 P00492 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
SIRT3 Q9NTG7 1/20 0.35

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
SCHEMBL577858 0.76 IFNAR1 (0.60) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL31167972 0.76 IFNAR1 (0.60) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL1127496 0.76 HPGD (0.39) MAPK1HSD17B10SMN1; SMN2MAPTSIRT1
SCHEMBL30548749 0.74 IFNAR1 (0.58) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL653427 0.73 IFNAR1 (0.42) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL2460073 0.71 CYP1A2 (0.31) TDP1CYP1A2
SCHEMBL16581496 0.70 IFNAR1 (0.44) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL31490493 0.69 IFNAR1 (0.49) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL2890325 0.69 IFNAR1 (0.49) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL30544440 0.69 HPRT1 (0.64) IFNAR1ALDH1A1LMNAMAPK1NPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4675316-A FUNGICIDES ROHM AND HAAS COMPANY (US) 1987-06-23 US claimed
EP-1180765-B1 Optical recording medium and porphycene compound MITSUI CHEMICALS INC (JP) 2005-04-06 EP disclosed
EP-1180765-A1 Optical recording medium and porphycene compound Mitsui Chemicals, Inc. (JP) 2002-02-20 EP disclosed
US-6106999-A SENSITIVITY TO GENERAL-PURPOSE VISIBLE LIGHT LASER, SO THAT HIGH-SPEED SCANNING EXPOSURE IS POSSIBLE BY LASER, AND EXTREMELY FINE HIGH RESOLUTION CAN BE OBTAINED; CAN BE USED FOR COATING OR PRINTING UNDER SAFELIGHT IRRADIATING CONDITIONS MITSUI CHEMICALS (JP) 2000-08-22 US disclosed