SCHEMBL353025

SCHEMBL353025

Cc1cccc2c1nc(C)n2C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.59
CYP3A4 P08684 2/20 0.59
CYP2C9 P11712 2/20 0.59
CYP2C19 P33261 2/20 0.59
CYP2D6 P10635 1/20 0.59
TLR8 Q9NR97 1/20 0.45
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 1/20 0.44
ALKBH5 Q6P6C2 1/20 0.41
FTO Q9C0B1 1/20 0.41
PDE10A Q9Y233 1/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
HCRTR1 O43613 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.38
PSEN1 P49768 1/20 0.36

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
Formamide SCHEMBL28367514 0.89 CYP1A2 (0.51) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL9144151 0.80 TLR8 (0.43) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL6118671 0.80 FBP1 (0.49) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL17561705 0.80 CYP1A2 (0.49) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL13543521 0.80 CYP1A2 (0.49) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL9753219 0.80 TLR8 (0.43) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL3194071 0.80 CYP1A2 (0.49) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL3295739 0.80 CYP1A2 (0.49) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL2541919 0.80 TLR8 (0.58) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL14957163 0.79 TLR8 (0.42) CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6

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 132 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200054664-A1 METABOLIC SUPPLEMENT FORMULATION AND METHODS OF USE FOR TREATING DEPRESSION AND ANXIETY HAWKINS GERMAINE BERNARD (US) 2020-02-20 US claimed
EP-2445518-A1 COBALAMIN TAXANE BIOCONJUGATES FOR TREATING EYE DISEASE Osiris Therapeutics, Inc. (US) 2012-05-02 EP claimed
US-20110166097-A1 TAXANE COMPOUNDS FOR TREATING EYE DISEASE OSIRIS THERAPEUTICS, INC. (US) 2011-07-07 US claimed
EP-2320728-A1 TAXANE COMPOUNDS FOR TREATING EYE DISEASE Osiris Therapeutics, Inc. (US) 2011-05-18 EP claimed
WO-2010088287-A1 COBALAMIN TAXANE BIOCONJUGATES FOR TREATING EYE DISEASE GEBHARD JOHN R (US) 2010-08-05 WO claimed
JP-2010509488-A 2010-03-25 JP claimed
WO-2010011662-A1 TAXANE COMPOUNDS FOR TREATING EYE DISEASE INFLABLOC PHARMACEUTICALS, INC. (US) 2010-01-28 WO claimed
US-20100016256-A1 Taxane Compounds for Treating Eye Disease OSIRIS THERAPEUTICS, INC 2010-01-21 US claimed
EP-2139469-A2 COBALAMIN TAXANE BIOCONJUGATES Inflabloc Pharmaceuticals, Inc. (US) 2010-01-06 EP claimed
EP-1978997-A1 TRANSDERMAL DELIVERY OF PHARMACEUTICAL AGENTS Apollo Life Sciences Limited (AU) 2008-10-15 EP claimed
EP-0700295-A4 VITAMIN B 12? MEDIATED ORAL DELIVERY SYSTEMS FOR GCSF AND EPO BIOTECH AUSTRALIA PTY LTD (AU) 1998-09-30 EP claimed
EP-0701448-A4 AMPLIFICATION OF THE VITAMIN B 12? UPTAKE SYSTEM USING POLYMERS BIOTECH AUSTRALIA PTY LTD (AU) 1997-01-02 EP claimed
US-5548064-A COLONY STIMULATING FACTOR; ORAL ADMINISTERING BIOTECH AUSTRALIA PTY LIMITED (AU) 1996-08-20 US claimed
CN-1126436-A Vitamin B12 mediated oral delivery systems for GCSF and EPO BIOTECH AUSTRALIA PTY LTD (AU) 1996-07-10 CN claimed
CN-1126441-A Amplification of vitamin B12 absorption System Using polymers BIOTECH AUSTRALIA PTY LTD (AU) 1996-07-10 CN claimed
EP-0701448-A1 AMPLIFICATION OF THE VITAMIN B 12? UPTAKE SYSTEM USING POLYMERS BIOTECH AUSTRALIA PTY. LIMITED (AU) 1996-03-20 EP claimed
EP-0700295-A1 VITAMIN B 12? MEDIATED ORAL DELIVERY SYSTEMS FOR GCSF AND EPO BIOTECH AUSTRALIA PTY. LIMITED (AU) 1996-03-13 EP claimed
US-5449720-A Amplification of the VB12 uptake system using polymers BIOTECH AUSTRALIA PTY LIMITED (AU) 1995-09-12 US claimed
WO-1994027613-A1 VITAMIN B12 MEDIATED ORAL DELIVERY SYSTEMS FOR GCSF AND EPO BIOTECH AUSTRALIA PTY. LIMITED (AU) 1994-12-08 WO claimed
WO-1994027641-A1 AMPLIFICATION OF THE VITAMIN B12 UPTAKE SYSTEM USING POLYMERS BIOTECH AUSTRALIA PTY. LIMITED (AU) 1994-12-08 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100016256-A1 Taxane Compounds for Treating Eye Disease TTR, BTD, MTHFD1 CYP1A2 1237/4885CYP3A4 3978/4885CYP2C9 2914/4885
US-20110166097-A1 TAXANE COMPOUNDS FOR TREATING EYE DISEASE TTR, BTD, MTHFD1 CYP1A2 1237/4885CYP3A4 3978/4885CYP2C9 2914/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.