SCHEMBL20169592

SCHEMBL20169592

Cc1cc(C)c(O)c(Cc2c(C)ccc(Cc3cccc(C)c3O)c2O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.41
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
HIF1A Q16665 2/20 0.40
CYP2D6 P10635 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HSPA5 P11021 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HSP90AA1 P07900 1/20 0.36
GAA P10253 2/20 0.35
TRPA1 O75762 1/20 0.34
CNR2 P34972 1/20 0.34
GPR55 Q9Y2T6 1/20 0.34
PSMB5 P28074 1/20 0.34
EGFR P00533 1/20 0.33
ERBB2 P04626 1/20 0.33
CALM1 P0DP23 1/20 0.33
SHBG P04278 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL28675364 0.89 AMY1A (0.50) AMY1ACYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL9346537 0.89 ALDH1A1 (0.46) CYP2C19HSD17B10HSPA5ALDH1A1HSP90AA1
SCHEMBL22500183 0.86 AMY1A (0.46) AMY1ACYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL9341585 0.84 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL20154792 0.84 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL30374717 0.84 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL30375451 0.81 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL29290543 0.81 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL29636517 0.79 CYP2C9 (0.50) AMY1ACYP2C9CYP2C19HIF1ACYP2D6
SCHEMBL29468157 0.79 CYP2C9 (0.50) AMY1ACYP2C9CYP2C19HIF1ACYP2D6

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-10007183-B2 Compound for forming organic film, and organic film composition using the same, process for forming organic film, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-06-26 US disclosed
US-9977330-B2 Compound for forming organic film, and organic film composition using the same, process for forming organic film, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-05-22 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-10007183-B2 Compound for forming organic film, and organic film composition using the same, process for forming organic film, and patterning process OR10J3, RER1, OLA1 AMY1A 1146/4885CYP2C9 2832/4885CYP2C19 2750/4885

“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.