SCHEMBL19700321

SCHEMBL19700321

Brc1ccc(CN(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 5/20 0.55
CNR2 P34972 1/20 0.53
TSHR P16473 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 5/20 0.46
TRPA1 O75762 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPK1 P28482 1/20 0.44
AOC3 Q16853 1/20 0.43
MAOB P27338 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL29083510 0.90 PYCR1 (0.64) PYCR1ALDH1A1KDM4EMAOB
SCHEMBL12049793 0.87 CNR2 (0.64) CNR2TSHRHTTALDH1A1TRPA1
SCHEMBL6621416 0.86 FNTA (0.54) PYCR1L3MBTL1ALDH1A1TDP1KDM4E
SCHEMBL134524 0.84 TSHR (0.60) CNR2TSHRALDH1A1TRPA1TDP1
SCHEMBL5703578 0.82 PYCR1 (0.58) PYCR1CNR2TSHRL3MBTL1HTT
SCHEMBL4821913 0.82 CALM1 (0.55) PYCR1CNR2TSHRL3MBTL1HTT
Ammonia Solution, Strong SCHEMBL1348044 0.82 CNR2 (0.58) CNR2TSHRALDH1A1TRPA1TDP1
Bromide SCHEMBL11212819 0.82 CNR2 (0.58) CNR2TSHRALDH1A1TRPA1TDP1
Fluoride SCHEMBL633879 0.82 CNR2 (0.58) CNR2TSHRALDH1A1TRPA1TDP1
Bromide SCHEMBL6760453 0.82 CNR2 (0.58) CNR2TSHRALDH1A1TRPA1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10651390-B2 Tertiary amine compound, photoelectric conversion element, and solar cell RICOH COMPANY, LTD. (JP) 2020-05-12 US disclosed
US-20170358399-A1 TERTIARY AMINE COMPOUND, PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL RICOH COMPANY, LTD. (JP) 2017-12-14 US disclosed
US-20170358399-A1 TERTIARY AMINE COMPOUND, PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL RICOH COMPANY, LTD. (JP) 2017-12-14 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 (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-20170358399-A1 TERTIARY AMINE COMPOUND, PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL SUN2, CRY1, TEAD1 PYCR1 2553/4885CNR2 1649/4885TSHR 2632/4885
US-10651390-B2 Tertiary amine compound, photoelectric conversion element, and solar cell SUN2, CRY1, TEAD1 PYCR1 2553/4885CNR2 1649/4885TSHR 2632/4885

“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.