SCHEMBL17734641

SCHEMBL17734641

Cc1cc(-c2ccc(N(c3ccc([Si](C)(C)C)cc3)c3ccccc3-c3ccccc3)c(C)c2)ccc1N(c1ccc([Si](C)(C)C)cc1)c1ccccc1-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.35
▸ PTAFR P25105 1/20 0.33
▸ ENPP3 O14638 1/20 0.32
▸ ENPP1 P22413 1/20 0.32
▸ PSMB5 P28074 1/20 0.32
▸ CRHR1 P34998 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ TACR1 P25103 2/20 0.31
▸ PDE3B Q13370 1/20 0.31
▸ PDE3A Q14432 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL17734620 0.90 RARA (0.32) PSMB5MAPTPDE3BPDE3A
SCHEMBL17734517 0.89 ESR1 (0.39) ESR1PSMB5CRHR1MAPTTACR1
SCHEMBL17734832 0.89 ESR1 (0.39) ESR1PSMB5CRHR1MAPTTACR1
SCHEMBL17734494 0.89 ESR1 (0.39) ESR1PSMB5CRHR1MAPTTACR1
SCHEMBL17734823 0.89 ESR1 (0.39) ESR1PSMB5CRHR1MAPTTACR1
SCHEMBL17734492 0.87 ESR1 (0.40) ESR1ENPP3ENPP1PSMB5CRHR1
SCHEMBL17734533 0.86 ESR1 (0.38) ESR1PSMB5CRHR1MAPTTACR1
SCHEMBL17734498 0.86 ESR1 (0.38) ESR1CRHR1MAPTNPC1ALDH1A1
SCHEMBL17734829 0.86 ESR1 (0.38) ESR1PSMB5CRHR1MAPTTACR1
SCHEMBL17734822 0.86 ESR1 (0.39) ESR1CRHR1MAPTTACR1NPC1

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-20160133847-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2016-05-12 — — US disclosed
US-20160133847-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2016-05-12 — — 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-20160133847-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT ARL1, CCNL2, APOL1 ESR1 15/4885PTAFR 4800/4885ENPP3 3390/4885

“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.

Send feedback