SCHEMBL21335261

SCHEMBL21335261

C=C/C(=C\C=C(/C)N(c1ccc(-c2ccc3oc4ccccc4c3c2)cc1)c1ccc2ccccc2c1)c1cccc2c1oc1ccccc12

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTPRF P10586 6/20 0.36
▸ PTPN2 P17706 6/20 0.36
▸ PTPN1 P18031 6/20 0.36
▸ ALOX5 P09917 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ MAOB P27338 1/20 0.30

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
SCHEMBL20121355 0.97 PTPRF (0.36) PTPRFPTPN2PTPN1ALOX5NPC1
SCHEMBL21335292 0.90 PTPRF (0.33) PTPRFPTPN2PTPN1ALOX5
SCHEMBL22756960 0.74 — —
SCHEMBL22932521 0.70 SIRT2 (0.37) —
SCHEMBL18802484 0.70 ALOX5 (0.36) PTPRFPTPN2PTPN1ALOX5NPC1
SCHEMBL22057753 0.70 NPC1 (0.37) PTPRFPTPN2PTPN1ALOX5NPC1
SCHEMBL15496222 0.69 ALOX5 (0.46) PTPRFPTPN2PTPN1ALOX5NPC1
SCHEMBL10307230 0.69 ALOX5 (0.37) PTPRFPTPN2PTPN1ALOX5NPC1
SCHEMBL15496239 0.69 MAPT (0.41) NPC1CYP1A2CYP2C9CYP2C19RAB9A
SCHEMBL10307229 0.68 ALOX5 (0.47) PTPRFPTPN2PTPN1ALOX5NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10411192-B2 Aromatic amine compound, organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2019-09-10 — — 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-10411192-B2 Aromatic amine compound, organic electroluminescent element and electronic device AOC2, PNMT, TYR PTPRF 4320/4885PTPN2 4372/4885PTPN1 4567/4885

“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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