SCHEMBL1042983

SCHEMBL1042983

CCCCCCCCCCCCCCCCCCn1c(CCCN)nc2ccccc2c1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.64
TSHR P16473 3/20 0.64
PDE4A P27815 1/20 0.62
PDE4B Q07343 1/20 0.62
PDE4C Q08493 1/20 0.62
PDE4D Q08499 1/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
ATM Q13315 1/20 0.62
PTK2B Q14289 1/20 0.58
TLR8 Q9NR97 3/20 0.57
TLR7 Q9NYK1 2/20 0.57
TDP1 Q9NUW8 2/20 0.55
ALDH1A1 P00352 3/20 0.51
MAPK1 P28482 1/20 0.51
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
ESR1 P03372 1/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
L3MBTL1 Q9Y468 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
SCHEMBL8481498 1.00 LMNA (0.64) LMNATSHRPDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL1038937 0.94 LMNA (0.66) LMNATSHRPDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL8486883 0.94 LMNA (0.66) LMNATSHRPDE4APDE4BPDE4C
SCHEMBL4958108 0.93 PDE4A (0.69) LMNATSHRPDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL4955764 0.91 PDE4A (0.67) LMNATSHRPDE4APDE4BPDE4C
SCHEMBL11501103 0.91 PDE4A (0.70) LMNATSHRPDE4APDE4BPDE4C
SCHEMBL4958962 0.89 PDE4A (0.70) LMNATSHRPDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL4956228 0.88 PDE4A (0.69) LMNATSHRPDE4APDE4BPDE4C
SCHEMBL14259780 0.86 TSHR (0.64) LMNATSHRPDE4APDE4BPDE4C
SCHEMBL1037717 0.86 PDE4A (0.60) LMNATSHRPDE4APDE4BPDE4C

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
EP-0903344-B1 Quinazolin-4-one derivatives, their preparation and their use as hair growth promoters or in external compositions for skin SHISEIDO CO LTD (JP) 2011-01-26 EP disclosed
US-5972929-A Quinazolinone derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO., LTD. (JP) 1999-10-26 US disclosed
EP-0903344-A1 Quinazolin-4-one derivatives, their preparation and their use as hair growth promoters or in external compositions for skin SHISEIDO COMPANY LIMITED (JP) 1999-03-24 EP disclosed