SCHEMBL17944015

SCHEMBL17944015

O=c1c(O)c(-c2ccc(-c3cccs3)cc2)oc2cc3ccccc3cc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 11/20 0.57
▸ MEN1 O00255 10/20 0.57
▸ KMT2A Q03164 10/20 0.57
▸ MAPK1 P28482 5/20 0.57
▸ CASP1 P29466 4/20 0.57
▸ CASP7 P55210 4/20 0.57
▸ USP2 O75604 3/20 0.57
▸ HTT P42858 3/20 0.57
▸ GAA P10253 2/20 0.57
▸ TSHR P16473 2/20 0.57
▸ MAPT P10636 8/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ POLB P06746 1/20 0.55
▸ CYP3A4 P08684 9/20 0.49
▸ HSD17B10 Q99714 8/20 0.49
▸ ALOX15 P16050 4/20 0.49
▸ ALDH1A1 P00352 5/20 0.48
▸ TP53 P04637 5/20 0.48
▸ HPGD P15428 4/20 0.48
▸ CYP2C9 P11712 4/20 0.48

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
SCHEMBL17940142 0.83 CYP3A4 (0.68) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL17944028 0.81 TP53 (0.70) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL17940164 0.79 KDM4E (0.56) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL17943841 0.78 KDM4E (0.52) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL25236581 0.77 MEN1 (0.70) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL17940134 0.75 MAPT (0.49) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL5246464 0.73 KDM4E (1.00) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL25231618 0.73 MEN1 (0.60) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL74701 0.72 CYP3A4 (0.74) KDM4EMEN1KMT2AMAPK1CASP1
SCHEMBL25204955 0.72 MEN1 (0.62) KDM4EMEN1KMT2AMAPK1CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9840488-B2 Carbon monoxide releasing molecules and associated methods UTAH STATE UNIVERSITY (US) 2017-12-12 — — US disclosed
US-9840488-B2 Carbon monoxide releasing molecules and associated methods UTAH STATE UNIVERSITY (US) 2017-12-12 — — US disclosed
US-20160214955-A1 Carbon Monoxide Releasing Molecules and Associated Methods UTAH STATE UNIVERSITY (US) 2016-07-28 — — US disclosed
US-20160214955-A1 Carbon Monoxide Releasing Molecules and Associated Methods UTAH STATE UNIVERSITY (US) 2016-07-28 — — 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 (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-20160214955-A1 Carbon Monoxide Releasing Molecules and Associated Methods MB, CORO1C, CYCS KDM4E 1691/4885MEN1 3240/4885KMT2A 3110/4885

“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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