SCHEMBL20116087

SCHEMBL20116087

COc1ccc(-c2noc(C3CCN(C(=O)CNC(=O)c4ccccc4)CC3)n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ TSHR P16473 2/20 0.59
▸ HTT P42858 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.58
▸ GAA P10253 1/20 0.58
▸ ALOX15 P16050 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ TUBB4A P04350 5/20 0.56
▸ TUBB P07437 5/20 0.56
▸ TUBA3C P0DPH7 5/20 0.56
▸ TUBA1B P68363 5/20 0.56
▸ TUBA4A P68366 5/20 0.56
▸ TUBB4B P68371 5/20 0.56
▸ TUBB3 Q13509 5/20 0.56
▸ TUBB2A Q13885 5/20 0.56
▸ TUBB8 Q3ZCM7 5/20 0.56
▸ TUBA3E Q6PEY2 5/20 0.56
▸ TUBA1A Q71U36 5/20 0.56
▸ TUBA1C Q9BQE3 5/20 0.56

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
SCHEMBL22357793 0.92 TSHR (0.53) ALDH1A1LMNATSHRHTTKDM4E
SCHEMBL20116079 0.91 TUBB4A (0.66) LMNATSHRALOX15MAPK1TUBB4A
SCHEMBL20116082 0.90 TSHR (0.62) ALDH1A1TSHRGAAMAPK1TUBB4A
SCHEMBL30506219 0.90 TSHR (0.62) ALDH1A1TSHRGAAMAPK1TUBB4A
SCHEMBL20116462 0.89 SMO (0.57) LMNATSHRHTTALOX15MAPK1
SCHEMBL30720960 0.89 SMO (0.57) LMNATSHRHTTALOX15MAPK1
SCHEMBL20116117 0.88 LMNA (0.72) ALDH1A1LMNATSHRHTTGAA
SCHEMBL20116091 0.88 TUBB4A (0.53) ALDH1A1LMNATSHRHTTKDM4E
SCHEMBL30506264 0.88 TUBB4A (0.53) ALDH1A1LMNATSHRHTTKDM4E
SCHEMBL20660861 0.86 TUBB4A (0.54) ALDH1A1LMNATSHRHTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117777121-A Compounds and uses thereof 詹森药业有限公司 2024-03-29 — — CN disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 — — US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 — — US disclosed
CN-110099898-B Compounds and uses thereof 优曼尼蒂治疗公司 2023-07-25 — — CN disclosed
EP-3700934-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2020-09-02 — — EP disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 — — US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 — — WO disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 — — WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 — — WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 — — WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 — — WO 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 ALDH1A1 656/4885LMNA 1966/4885TSHR 4679/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 ALDH1A1 656/4885LMNA 1966/4885TSHR 4679/4885

“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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