SCHEMBL4893877

SCHEMBL4893877

Cc1ccc(N(c2ccc(C)cc2)c2ccc(N(c3ccc(C)cc3)c3ccc(N(c4ccc(C)cc4)c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
TSHR P16473 4/20 0.61
ACHE P22303 6/20 0.57
TDP1 Q9NUW8 2/20 0.57
CA2 P00918 2/20 0.43
LPL P06858 1/20 0.43
LIPG Q9Y5X9 1/20 0.43
MAPT P10636 2/20 0.42
CYP2C19 P33261 2/20 0.42
MCOLN3 Q8TDD5 1/20 0.42
CA1 P00915 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CHRNA7 P36544 1/20 0.39

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
SCHEMBL615437 1.00 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1CA2
SCHEMBL6123161 1.00 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1CA2
SCHEMBL16982395 1.00 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1CA2
SCHEMBL7486403 1.00 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1CA2
SCHEMBL12240222 1.00 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1CA2
SCHEMBL76680 1.00 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1CA2
Hydrochloric Acid SCHEMBL25295730 0.97 ALDH1A1 (0.58) ALDH1A1TSHRACHETDP1CA2
Ammonia Solution, Strong SCHEMBL8759606 0.97 ALDH1A1 (0.58) ALDH1A1TSHRACHETDP1CA2
Iodide SCHEMBL9495385 0.97 ALDH1A1 (0.58) ALDH1A1TSHRACHETDP1CA2
Hydrochloric Acid SCHEMBL8469549 0.94 ALDH1A1 (0.55) ALDH1A1TSHRACHETDP1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080058552-A1 Novel Aromatic Tertiary Amines and Use Thereof as Organic Electronic Functional Material BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2008-03-06 US disclosed
EP-1829855-A1 NOVEL AROMATIC TERTIARY AMINES AND UTILIZATION THEREOF AS ORGANIC ELECTRONIC FUNCTIONAL MATERIAL BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2007-09-05 EP 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-20080058552-A1 Novel Aromatic Tertiary Amines and Use Thereof as Organic Electronic Functional Material SLC18A1, PAH, TYR ALDH1A1 463/4885TSHR 2984/4885ACHE 420/4885

“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.