SCHEMBL3514830

SCHEMBL3514830

Cc1cc(CCCc2ccc(N)c(C)c2)ccc1N

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.81
CYP3A4 P08684 4/20 0.50
ALDH1A1 P00352 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
TSHR P16473 2/20 0.50
S100B P04271 1/20 0.44
SLC28A3 Q9HAS3 1/20 0.39
ESR1 P03372 2/20 0.39
AR P10275 1/20 0.39
ESR2 Q92731 1/20 0.39
MAPK1 P28482 1/20 0.39
ALOX15 P16050 4/20 0.38
IGF1R P08069 2/20 0.38
RAD52 P43351 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
HIF1A Q16665 2/20 0.37
THRB P10828 1/20 0.37
RECQL P46063 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL28125839 0.93 SKP2 (0.78) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL841783 0.91 SKP2 (0.73) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL31634603 0.91 SKP2 (0.73) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL23093003 0.90 SKP2 (0.72) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL4638583 0.90 SKP2 (1.00) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL3482834 0.88 SKP2 (0.70) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL22604978 0.88 SKP2 (0.89) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL23093076 0.88 SKP2 (0.70) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL8099671 0.88 SKP2 (0.65) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL11869178 0.86 SKP2 (0.86) SKP2CYP3A4ALDH1A1ESR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420764-B2 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2013-04-16 US disclosed
US-8236917-B2 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2012-08-07 US disclosed
US-20120178894-A1 COMPOUND HAVING SILSESQUIOXANE SKELETON AND ITS POLYMER INAGAKI JYUN-ICHI (JP) 2012-07-12 US disclosed
US-20100240855-A1 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2010-09-23 US disclosed
US-7507450-B2 Varnish for forming liquid crystal alignment layer and liquid crystal display element using the same CHISSO CORPORATION (JP) 2009-03-24 US disclosed
US-7373060-B2 Optical waveguide using polymer composed of silsesquioxane derivative CHISSO CORPORATION (JP) 2008-05-13 US disclosed
US-20060204192-A1 Optical waveguide using polymer composed of silsesquioxane derivative JNC CORPORATION (JP) 2006-09-14 US disclosed
US-20060204680-A1 Varnish for forming liquid crystal alignment layer and liquid crystal display element using the same JNC CORPORATION (JP) 2006-09-14 US disclosed
US-6949281-B1 Varnish composition and liquid-crystal display element CHISSO CORPORATION (JP) 2005-09-27 US disclosed
US-6946169-B1 Polyamic acid composition, liquid crystal aligning film, and liquid crystal display element CHISSO CORPORATION (JP) 2005-09-20 US disclosed
US-20050009982-A1 Compound having silsesquioxane skeleton and its polymer CHISSO CORPORATION (JP) 2005-01-13 US disclosed
US-6746730-B1 VARNISH COMPOSITION WHICH COMPRISES POLYMER COMPONENT CONTAINING TWO DIFFERENT POLYAMIC ACIDS, SOLUBLE POLYIMIDE, AND SOLVENT FOR DISSOLVING POLYMER COMPONENT CHISSO CORPORATION (JP) 2004-06-08 US disclosed
US-6685997-B1 SOLUTION CONTAINING POLYAMIC ACIDS, POLYAMIDES AND POLYIMIDES; ALIGNMENT FILM; WELL BALANCED ELECTRICAL CHARACTERISTICS; ELIMINATES IMAGE STICKING CHISSO CORPORATION (JP) 2004-02-03 US disclosed
US-6620339-B1 Providing polyimide resin with large pretilt angle; small residual voltage and high voltage holding ratio; reliable CHISSO CORPORATION (JP) 2003-09-16 US disclosed
EP-1064319-B1 POLYAMIC ACID COMPOSITION, LIQUID CRYSTAL ALIGNING FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORP (JP) 2003-02-19 EP disclosed
US-6316574-B1 FOR PRODUCING ALIGNING FILMS, PROTECTION FILMS, INSULATION FILMS ELECTRICAL PROPERTIES AND RELIABILITY; FOR USE IN ELECTRONIC MATERIALS CHISSO CORPORATION (JP) 2001-11-13 US disclosed
EP-1042701-A1 POLYAMIC ACID COMPOSITION, LIQUID CRYSTAL ALIGNING FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 2000-10-11 EP disclosed
WO-1999034252-A1 POLYAMIC ACID COMPOSITION, LIQUID CRYSTAL ALIGNING FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1999-07-08 WO 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-20050009982-A1 Compound having silsesquioxane skeleton and its polymer C1S, H1-4, H1-0 SKP2 60/4885CYP3A4 1082/4885ALDH1A1 1780/4885

“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.