SCHEMBL20830065

SCHEMBL20830065

C=C/C=C(/c1ccccn1)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.44
▸ KDM4E B2RXH2 5/20 0.44
▸ HTT P42858 2/20 0.44
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ NAPRT Q6XQN6 1/20 0.40
▸ P4HTM Q9NXG6 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ RAB9A P51151 6/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ PTBP1 P26599 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ NPC1 O15118 5/20 0.38
▸ MAPT P10636 3/20 0.38
▸ PKM P14618 3/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ KMT2A Q03164 2/20 0.38

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
SCHEMBL24589250 0.82 ALDH1A1 (0.49) ALDH1A1KDM4EHTTCES2CES1
SCHEMBL10465175 0.77 ALDH1A1 (0.52) ALDH1A1KDM4EHTTCES2CES1
SCHEMBL18410851 0.77 ALDH1A1 (0.52) ALDH1A1KDM4EHTTCES2CES1
SCHEMBL19393364 0.76 ALDH1A1 (0.44) ALDH1A1KDM4EHTTCES2CES1
SCHEMBL19750324 0.74 CYP1A2 (0.40) RAB9ANPC1HSP90AA1
SCHEMBL27611283 0.73 CES2 (0.45) ALDH1A1KDM4EHTTCES2CES1
SCHEMBL20825179 0.73 MAPK1 (0.50) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL19154947 0.73 MAPK1 (0.50) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL20683516 0.72 ALDH1A1 (0.43) ALDH1A1KDM4EHTTCES2CES1
SCHEMBL19450871 0.72 ALDH1A1 (0.43) ALDH1A1KDM4EHTTCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230354692-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-11-02 — — US disclosed
US-11778897-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-10-03 — — US disclosed
US-20230026303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-01-26 — — US disclosed
US-20230020526-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-01-19 — — US disclosed
EP-4112701-A2 MOLECULAR ALIGNMENT OF HOMOLEPTIC IRIDIUM PHOSPHORS University of Southern California (US) 2023-01-04 — — EP disclosed
US-20220336747-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-10-20 — — US disclosed
US-20220115601-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORP (US) 2022-04-14 — — US disclosed
US-11038115-B2 Organic electroluminescent materials and device UNIVERSAL DISPLAY CORPORATION (US) 2021-06-15 — — US disclosed
US-10957866-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2021-03-23 — — US disclosed
US-20190088887-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2019-03-21 — — 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 (8 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-20230026303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OR10J3, OXER1, OCIAD1 ALDH1A1 1292/4885KDM4E 3235/4885HTT 3869/4885
US-20220336747-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OSBP ALDH1A1 184/4885KDM4E 2866/4885HTT 3619/4885
US-20190088887-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LIFR, LBR, ZFR ALDH1A1 2258/4885KDM4E 1788/4885HTT 4218/4885
US-20230020526-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES RO60, RPS10, SOD1 ALDH1A1 1595/4885KDM4E 2143/4885HTT 2195/4885
US-20220115601-A1 Organic Electroluminescent Materials and Devices OCIAD1, OCIAD2, JUND ALDH1A1 400/4885KDM4E 666/4885HTT 3887/4885
US-11778897-B2 Organic electroluminescent materials and devices LIFR, LBR, ZFR ALDH1A1 2258/4885KDM4E 1788/4885HTT 4218/4885
US-10957866-B2 Organic electroluminescent materials and devices TYR, YAP1, PAXBP1 ALDH1A1 2717/4885KDM4E 2172/4885HTT 2837/4885
US-20230354692-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LIFR, LBR, ZFR ALDH1A1 2258/4885KDM4E 1788/4885HTT 4218/4885

“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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