SCHEMBL20873019

SCHEMBL20873019

C=Cc1ccc2c[c]c3ccccc3c2c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TYMS P04818 1/20 0.33
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HIF1A Q16665 1/20 0.32
CYP1B1 Q16678 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL20872985 0.85 ALDH1A1 (0.33) ALDH1A1TSHRMEN1KMT2ATP53
SCHEMBL20873038 0.78 XDH (0.38) ALDH1A1TSHRMEN1KMT2ATP53
SCHEMBL38666753 0.77 ALDH1A1 (0.56) ALDH1A1TSHRMEN1KMT2ATYMS
SCHEMBL1778036 0.77 ALDH1A1 (0.56) ALDH1A1TSHRMEN1KMT2ATYMS
SCHEMBL18317662 0.75 CYP2A6 (0.42) ALDH1A1MEN1KMT2ATDP1HIF1A
SCHEMBL25131 0.75 ALDH1A1 (0.46) ALDH1A1TSHRTDP1HIF1ACYP1B1
SCHEMBL20872977 0.74 CA12 (0.42) ALDH1A1MEN1KMT2A
SCHEMBL9958428 0.74 ESR1 (0.39) ALDH1A1HIF1ACYP1B1HSD17B10
SCHEMBL27616289 0.73 ALDH1A1 (0.43) ALDH1A1TSHRTDP1HIF1ACYP1B1
SCHEMBL2452867 0.73 ALDH1A1 (0.61) ALDH1A1TSHRTDP1HIF1ACYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109154677-B Low viscosity agent for high refractive index polymerizable compound and polymerizable composition containing same 日产化学株式会社 2022-07-05 CN disclosed
CN-109153691-B Polymerizable silane compound 日产化学株式会社 2021-07-09 CN disclosed
CN-109196008-B Reactive polysiloxane and polymerizable composition containing same 日产化学株式会社 2021-07-06 CN disclosed
US-10899891-B2 Reactive polysiloxane and polymerizable composition comprising same NISSAN CHEMICAL CORPORATION (JP) 2021-01-26 US disclosed
US-10894800-B2 Polymerizable silane compound NISSAN CHEMICAL CORPORATION (JP) 2021-01-19 US disclosed
EP-3466956-B1 POLYMERIZABLE SILANE COMPOUND NISSAN CHEMICAL CORP (JP) 2020-12-09 EP disclosed
EP-3466994-B1 REACTIVE POLYSILOXANE AND POLYMERIZABLE COMPOSITION CONTAINING SAME NISSAN CHEMICAL CORP (JP) 2020-09-16 EP disclosed
US-20190256533-A1 POLYMERIZABLE SILANE COMPOUND NISSAN CHEMICAL CORPORATION (JP) 2019-08-22 US disclosed
US-20190256664-A1 REACTIVE POLYSILOXANE AND POLYMERIZABLE COMPOSITION COMPRISING SAME NISSAN CHEMICAL CORPORATION (JP) 2019-08-22 US disclosed
EP-3466994-A1 REACTIVE POLYSILOXANE AND POLYMERIZABLE COMPOSITION CONTAINING SAME Nissan Chemical Corporation (JP) 2019-04-10 EP disclosed
EP-3466956-A1 POLYMERIZABLE SILANE COMPOUND Nissan Chemical Corporation (JP) 2019-04-10 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 (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-20190256533-A1 POLYMERIZABLE SILANE COMPOUND PCNA, ARL1, CCNE1 ALDH1A1 958/4885TSHR 4498/4885MEN1 623/4885
US-10894800-B2 Polymerizable silane compound PCNA, ARL1, CCNE1 ALDH1A1 958/4885TSHR 4498/4885MEN1 623/4885

“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.