SCHEMBL2051019

SCHEMBL2051019

CCCCOc1cccc([O])c1OCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.50
▸ CYP2C9 P11712 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ CHRM2 P08172 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ CHRM1 P11229 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MCHR1 Q99705 1/20 0.44
▸ MAPT P10636 3/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41

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
SCHEMBL2043221 0.91 CHRM2 (0.49) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL1238407 0.86 LMNA (0.60) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL49257 0.82 CYP1A2 (0.60) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL7311322 0.82 LMNA (0.47) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL19056885 0.81 CYP1A2 (0.53) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL7930638 0.80 CYP1A2 (0.57) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL2042318 0.80 ALDH1A1 (0.47) CHRM2LMNACHRM1ALOX15TSHR
SCHEMBL19612454 0.79 SMN1; SMN2 (0.74) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL29091824 0.79 CYP1A2 (0.52) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL6709141 0.79 CYP1A2 (0.52) CYP1A2CYP2C9CYP2C19CHRM2LMNA

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-20110210322-A1 POLYMER COMPOUND CONTAINING NITROGEN-CONTAINING HETEROCYCLIC STRUCTURE, AND COMPOSITION, SOLUTION, THIN FILM AND POLYMER LIGHT-EMITTING ELEMENT EACH CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-09-01 — — US disclosed
EP-2336215-A1 POLYMER COMPOUND CONTAINING NITROGEN-CONTAINING HETEROCYCLIC STRUCTURE, AND COMPOSITION, SOLUTION, THIN FILM AND POLYMER LIGHT-EMITTING ELEMENT EACH CONTAINING SAME Sumitomo Chemical Company, Limited (JP) 2011-06-22 — — EP disclosed
US-4300942-A N-(Substituted carbonyl) derivatives of N-phos-phinylmethylglycinates and the herbicidal use thereof MONSANTO COMPANY (US) 1981-11-17 — — US disclosed
US-4251258-A N-(Substituted carbonyl) derivatives of N-phosphinylmethylglycinates and the herbicidal use thereof MONSANTO COMPANY (US) 1981-02-17 — — 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-20110210322-A1 POLYMER COMPOUND CONTAINING NITROGEN-CONTAINING HETEROCYCLIC STRUCTURE, AND COMPOSITION, SOLUTION, THIN FILM AND POLYMER LIGHT-EMITTING ELEMENT EACH CONTAINING SAME H1-10, RNF10, F10 CYP1A2 589/4885CYP2C9 2014/4885CYP2C19 1609/4885

“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.

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