SCHEMBL6159032

SCHEMBL6159032

CCCC(c1cc(C(C)(C)C)c(O)cc1C)(c1cc(C(C)(C)C)c(O)cc1C)c1c(C)cc(Cc2cc(C)cc(C(C)(C)C)c2O)c(O)c1Cc1cc(C)cc(C(C)(C)C)c1O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.51
CYP2C9 P11712 3/20 0.50
CYP2C19 P33261 3/20 0.50
HIF1A Q16665 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
CYP2D6 P10635 2/20 0.49
HSD17B10 Q99714 1/20 0.49
ALDH1A1 P00352 2/20 0.35
CA2 P00918 1/20 0.35
POLB P06746 1/20 0.35
TYR P14679 1/20 0.35
TP53 P04637 2/20 0.35
ALOX15 P16050 2/20 0.35
AMY1A P0DUB6 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 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
Butylated Hydroxytoluene SCHEMBL8487462 0.80 ALDH1A1 (0.53) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
Butane SCHEMBL28348075 0.75 SMN1; SMN2 (0.69) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL29498346 0.74 ALOX15 (0.53) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL225503 0.74 ALOX15 (0.53) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL11032991 0.73 CYP2C19 (0.82) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL29351672 0.71 HSPA5 (1.00) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL34162 0.71 HSPA5 (1.00) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL29415372 0.71 HSPA5 (1.00) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL9860200 0.71 CYP2C9 (0.73) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL7093399 0.70 SMN1; SMN2 (0.67) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050131244-A1 PROCESS FOR MANUFACTURE OF PENTAERYTHRITOL DIPHOSPHITES DOVER CHEMICAL CORPORATION (US) 2005-06-16 US disclosed
EP-0729946-B1 Condensates of butyne-linked hindered amines CIBA SC HOLDING AG (CH) 1999-12-15 EP disclosed
US-5703149-A Process for the preparation of stabilized olefin polymers CIBA SPECIALTY CHEMICALS CORPORATION (US) 1997-12-30 US disclosed
US-5387687-A Stabilize synthetic polymers against action of light, heat, oxidation CIBA-GEIGY CORPORATION (US) 1995-02-07 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-20050131244-A1 PROCESS FOR MANUFACTURE OF PENTAERYTHRITOL DIPHOSPHITES GNPAT, DCTPP1, DERA HSPA5 1440/4885CYP2C9 253/4885CYP2C19 413/4885

“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.