SCHEMBL17943840

SCHEMBL17943840

Cc1ccc(-c2oc3cc4ccccc4cc3c(=S)c2O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 5/20 0.51
▸ TSHR P16473 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ RET P07949 1/20 0.51
▸ ALOX12 P18054 1/20 0.51
▸ KDR P35968 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ MAPT P10636 6/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ CSNK2A2 P19784 4/20 0.42
▸ CSNK2B P67870 4/20 0.42
▸ CSNK2A1 P68400 4/20 0.42
▸ ABCG2 Q9UNQ0 3/20 0.41
▸ MAOB P27338 3/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ CYP3A4 P08684 5/20 0.39
▸ HSD17B10 Q99714 5/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39

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
SCHEMBL17940154 0.88 CYP3A4 (0.49) TP53TSHRLMNAALOX12MAPT
SCHEMBL17944028 0.83 TP53 (0.70) TP53TSHRLMNARETALOX12
SCHEMBL17940149 0.82 ALDH1A1 (0.39) TP53TSHRLMNARETALOX12
SCHEMBL17940142 0.71 CYP3A4 (0.68) TP53TSHRLMNARETALOX12
SCHEMBL23849203 0.70 HPGD (0.44) TP53TSHRMAPTKDM4EMAOB
SCHEMBL17943841 0.69 KDM4E (0.52) TP53TSHRLMNARETALOX12
SCHEMBL26661232 0.69 KDM4E (0.65) TP53TSHRLMNARETALOX12
SCHEMBL18595884 0.69 CYP3A4 (0.40) TSHRMAPTKDM4EMAOBCYP3A4
SCHEMBL10037935 0.68 TP53 (1.00) TP53TSHRLMNARETALOX12
SCHEMBL17940164 0.68 KDM4E (0.56) TP53TSHRLMNARETALOX12

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 2 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-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 TP53 1292/4885TSHR 4322/4885LMNA 3783/4885

“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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