SCHEMBL8993946

SCHEMBL8993946

CCOC(=O)CCCN(C)c1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.46
CYP3A4 P08684 3/20 0.46
LMNA P02545 2/20 0.46
MAOA P21397 2/20 0.46
ALOX5 P09917 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TNF P01375 4/20 0.44
PPIB P23284 1/20 0.43
PPIA P62937 1/20 0.43
PPID Q08752 1/20 0.43
PPIG Q13427 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
CYP4F2 P78329 2/20 0.41
CYP4A11 Q02928 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PHLPP2 Q6ZVD8 1/20 0.41
CYP2D6 P10635 3/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL8993953 0.95 CYP1A2 (0.45) CYP1A2CYP3A4LMNAMAOAALOX5
SCHEMBL8993978 0.94 CYP1A2 (0.44) CYP1A2CYP3A4LMNAMAOAALOX5
SCHEMBL14570550 0.88 SMN1; SMN2 (0.51) CYP1A2CYP3A4ALOX5SMN1; SMN2TNF
SCHEMBL21471540 0.86 CYP1A2 (0.42) CYP1A2CYP3A4LMNAMAOAALOX5
SCHEMBL22454703 0.85 L3MBTL1 (0.45) CYP1A2CYP3A4ALOX5SMN1; SMN2CYP4F2
SCHEMBL8993937 0.84 SMN1; SMN2 (0.63) CYP1A2CYP3A4ALOX5SMN1; SMN2TNF
SCHEMBL20493705 0.84 KMT2A (0.46) CYP1A2CYP3A4ALOX5SMN1; SMN2TNF
SCHEMBL6856568 0.84 CYP4F2 (0.49) CYP1A2CYP3A4ALOX5SMN1; SMN2TNF
SCHEMBL6327814 0.82 MMP2 (0.43) CYP1A2CYP3A4LMNAMAOAALOX5
SCHEMBL8993963 0.81 MMP14 (0.38) CYP1A2CYP3A4LMNAMAOAALDH1A1

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
EP-4711422-A1 DYES WITH PH-DEPENDENT ABSORPTION AND FLUORESCENCE ATTO-TEC Gmbh (DE) 2026-03-18 EP disclosed
US-5532171-A PHENOTHIAZINE DYES FOR PHOTODYNAMIC THERAPY OF CANCER OR IMMUNOASSAY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed
US-5344928-A Phenothiazine compounds for cancer treatment or immunoassay using chemiluminescence TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-09-06 US disclosed
EP-0510668-A2 Phenothiazine derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-28 EP disclosed