SCHEMBL11269090

SCHEMBL11269090

CCN(CC)c1ccc2ccc(C)[o+]c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.50
S100B P04271 1/20 0.44
ALDH1A1 P00352 11/20 0.42
L3MBTL1 Q9Y468 6/20 0.42
KDM4E B2RXH2 5/20 0.42
GLA P06280 2/20 0.42
CYP19A1 P11511 1/20 0.41
MAPT P10636 7/20 0.39
MEN1 O00255 7/20 0.39
KMT2A Q03164 7/20 0.39
ATM Q13315 3/20 0.39
MAOB P27338 2/20 0.39
USP2 O75604 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
CYP3A4 P08684 3/20 0.38
MAPK1 P28482 3/20 0.38
RECQL P46063 2/20 0.38
PSMD14 O00487 1/20 0.38
TSHR P16473 1/20 0.38

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
Bromide SCHEMBL2477887 0.81 TERT (0.58) TERTS100BALDH1A1L3MBTL1KDM4E
Hydrochloric Acid SCHEMBL94357 0.81 TERT (0.58) TERTS100BALDH1A1L3MBTL1KDM4E
Hydrochloric Acid SCHEMBL2477629 0.80 TERT (0.56) TERTS100BALDH1A1L3MBTL1KDM4E
Hydrochloric Acid SCHEMBL2479389 0.80 TERT (0.56) TERTS100BALDH1A1L3MBTL1KDM4E
SCHEMBL11273815 0.79 TERT (0.45) TERTALDH1A1KDM4EMAPTCYP3A4
SCHEMBL8596931 0.78 TERT (0.46) TERTS100BALDH1A1L3MBTL1KDM4E
SCHEMBL7612347 0.76 TERT (0.44) TERTS100BALDH1A1L3MBTL1KDM4E
SCHEMBL2477449 0.75 TERT (0.50) TERTS100BALDH1A1L3MBTL1KDM4E
SCHEMBL3899512 0.73 TERT (0.61) TERTS100BALDH1A1L3MBTL1KDM4E
SCHEMBL29549001 0.73 TERT (0.61) TERTS100BALDH1A1L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546590-B2 Polar dyes CEPHEID (US) 2013-10-01 US disclosed
US-20110053155-A1 POLAR DYES CEPHEID (US) 2011-03-03 US disclosed
US-7799926-B2 Polar dyes CEPHEID (US) 2010-09-21 US disclosed
US-4345073-A 7,7'-Diamino derivatives of 2,2'-spirodibenzopyranes BASF AKTIENGESELLSCHAFT (DE) 1982-08-17 US disclosed
US-4316027-A DYE INTERMEDIATES USED IN THE MANUFACTURE OF PRESSURE SENSITIVE RECORDING MATERIAL BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US disclosed
US-4110348-A PRESSURE SENSITIVE RECORDING BASF AKTIENGESELLSCHAFT (DE) 1978-08-29 US disclosed

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

For each of this compound's patents that has machine-readable text (1 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-20110053155-A1 POLAR DYES ANXA5, ANXA6, ARSA TERT 627/4885S100B 1048/4885ALDH1A1 4436/4885

“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.