SCHEMBL5015678

SCHEMBL5015678

CCCCCNc1cccc2c(S(=O)(=O)Cl)cccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51
▸ TP53 P04637 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ CNR1 P21554 1/20 0.48
▸ CNR2 P34972 1/20 0.48
▸ KCNA3 P22001 2/20 0.43
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ RGS12 O14924 1/20 0.40
▸ USP2 O75604 1/20 0.40

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
SCHEMBL5016478 0.87 CNR1 (0.52) TSHRMEN1KMT2ATDP1TP53
SCHEMBL11499376 0.85 L3MBTL1 (0.60) TSHRMEN1KMT2ATDP1TP53
SCHEMBL5022978 0.84 CNR1 (0.49) TSHRMEN1KMT2ATDP1TP53
SCHEMBL30069272 0.83 CNR1 (0.57) TSHRMEN1KMT2ATDP1CYP1A2
SCHEMBL23346286 0.81 CNR1 (0.56) TSHRMEN1KMT2ATDP1CYP1A2
SCHEMBL30069294 0.81 CNR1 (0.56) TSHRMEN1KMT2ATDP1CYP1A2
SCHEMBL10815702 0.78 CNR1 (0.55) TSHRMEN1KMT2ATDP1TP53
SCHEMBL5016181 0.78 L3MBTL1 (0.54) TSHRMEN1KMT2ATDP1TP53
SCHEMBL14174460 0.78 CA12 (0.62) CYP1A2CYP3A4CYP2C19KDM4EALDH1A1
SCHEMBL31006472 0.78 IDO1 (0.52) TSHRMEN1KMT2ATDP1CYP1A2

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-7365223-B2 Method for selective targeting of apoptotic cells and small molecule ligands used thereof NST NEUROSURVIVAL TECHNOLOGIES LTD (IL) 2008-04-29 — — US disclosed
US-20060160901-A1 Method for selective targeting of apoptotic cells and small molecule ligands used thereof APOSENSE LTD. (IL) 2006-07-20 — — 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-20060160901-A1 Method for selective targeting of apoptotic cells and small molecule ligands used thereof BAD, BAX, CASP3 TSHR 2988/4885MEN1 4258/4885KMT2A 4623/4885

“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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