SCHEMBL21041379

SCHEMBL21041379

COc1cccc(N2c3ccccc3N(c3ccccc3)[C@H]2C)c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 4/20 0.40
▸ MAPT P10636 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ FGFR1 P11362 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA4 P22748 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.35
▸ SMO Q99835 1/20 0.35
▸ MGLL Q99685 1/20 0.35

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
SCHEMBL21041374 0.83 LMNA (0.43) HSD11B1MAPTALDH1A1KDM4EHPGD
SCHEMBL22198906 0.79 HSD11B1 (0.31) HSD11B1
SCHEMBL12787319 0.78 GAA (0.39) ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL21041373 0.78 ALDH1A1 (0.38) MAPTALDH1A1KDM4EHPGDHTT
SCHEMBL22198979 0.75 HTR1A (0.30) —
SCHEMBL16220756 0.75 ALDH1A1 (0.39) HSD11B1MAPTALDH1A1KDM4EHPGD
SCHEMBL15397099 0.75 ALDH1A1 (0.39) HSD11B1MAPTALDH1A1KDM4EHPGD
SCHEMBL12643067 0.75 ALDH1A1 (0.39) HSD11B1MAPTALDH1A1KDM4EHPGD
SCHEMBL21970635 0.74 HIF1A (0.47) HSD11B1MAPTALDH1A1KDM4EHPGD
SCHEMBL21041378 0.74 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11758804-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-09-12 — — US disclosed
US-11758804-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-09-12 — — US disclosed
US-10301338-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-05-28 — — 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 (2 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-11758804-B2 Organic electroluminescent materials and devices OCIAD1, OSBP, OCIAD2 HSD11B1 1137/4885MAPT 2043/4885ALDH1A1 102/4885
US-10301338-B2 Organic electroluminescent materials and devices PNMT, TAAR5, TST HSD11B1 4681/4885MAPT 691/4885ALDH1A1 2954/4885

“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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