SCHEMBL16410896

SCHEMBL16410896

CCN(CC)Cc1c(O)ccc2c(=O)c(-c3nc4ccccc4s3)c(C)oc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 12/20 0.55
▸ GLA P06280 3/20 0.55
▸ HPGD P15428 9/20 0.53
▸ ALDH1A1 P00352 10/20 0.51
▸ MAPT P10636 4/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ HTT P42858 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ POLB P06746 2/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ RAB9A P51151 1/20 0.50
▸ HSD17B10 Q99714 3/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ CYP2C9 P11712 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ CYP3A4 P08684 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ CASP7 P55210 1/20 0.46

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
SCHEMBL16410900 0.83 POLB (0.65) KDM4EGLAHPGDALDH1A1MAPT
SCHEMBL17774411 0.81 KDM4E (0.69) KDM4EGLAHPGDALDH1A1MAPT
SCHEMBL17774416 0.81 KDM4E (0.68) KDM4EGLAHPGDALDH1A1MAPT
SCHEMBL17774414 0.80 KDM4E (0.67) KDM4EGLAHPGDALDH1A1MAPT
SCHEMBL13065924 0.78 KMT2A (0.63) KDM4EGLAHPGDALDH1A1MAPT
SCHEMBL16410991 0.77 KDM4E (0.84) KDM4EGLAHPGDALDH1A1MAPT
SCHEMBL17779067 0.72 KDM4E (0.53) KDM4EHPGDALDH1A1MAPTMEN1
SCHEMBL17774410 0.71 KDM4E (0.70) KDM4EGLAHPGDALDH1A1MAPT
SCHEMBL7455522 0.70 KDM4E (0.62) KDM4EGLAHPGDALDH1A1MAPT
SCHEMBL16410921 0.70 KDM4E (0.50) KDM4EGLAHPGDALDH1A1MAPT

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-9624211-B2 Anti-cancer compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-04-18 — — US disclosed
US-20160145250-A1 ANTI-CANCER COMPOUNDS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-05-26 — — US disclosed
WO-2015010032-A1 ANTI-CANCER COMPOUNDS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-01-22 — — 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 (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-20160145250-A1 ANTI-CANCER COMPOUNDS SKP2, TP53, TEAD2 KDM4E 472/4885GLA 1894/4885HPGD 2692/4885

“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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