SCHEMBL6064974

SCHEMBL6064974

COC(=O)C(Cl)(Cl)C(O)CCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.45
▸ CTRB1 P17538 3/20 0.45
▸ PRSS1 P07477 2/20 0.45
▸ CTSG P08311 2/20 0.45
▸ CMA1 P23946 2/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ METAP2 P50579 1/20 0.43
▸ METAP1 P53582 1/20 0.43
▸ CNR2 P34972 1/20 0.42
▸ BLM P54132 1/20 0.41
▸ KCNN4 O15554 1/20 0.41
▸ PPARG P37231 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ MMP12 P39900 1/20 0.40
▸ NPC1 O15118 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
SCHEMBL16414222 0.83 CTRB1 (0.52) TSHRCTRB1PRSS1CTSGCMA1
SCHEMBL10980771 0.75 KCNN4 (0.43) CTRB1PRSS1CTSGCMA1MEN1
SCHEMBL7993456 0.75 BLM (0.47) TSHRCNR2BLM
SCHEMBL9767865 0.74 KCNN4 (0.46) CTRB1CMA1MEN1KMT2AALDH1A1
SCHEMBL6823189 0.74 TRPA1 (0.49) CTRB1PRSS1CTSGCMA1KMT2A
SCHEMBL2935426 0.72 TSHR (0.51) TSHRSMN1; SMN2MEN1HTTKMT2A
SCHEMBL16419905 0.72 TSHR (0.47) TSHRCTRB1PRSS1CTSGCMA1
SCHEMBL6632225 0.72 TSHR (0.51) TSHRSMN1; SMN2MEN1HTTKMT2A
SCHEMBL6628027 0.72 TSHR (0.51) TSHRSMN1; SMN2MEN1HTTKMT2A
SCHEMBL9227502 0.72 MMP13 (0.44) TSHRMEN1KMT2AALDH1A1BLM

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-7084281-B2 Synthesis of dihalohydrins and tri- and tetra-substituted olefins BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-08-01 — — US disclosed
US-20040143125-A1 Synthesis of dihalohydrins and tri- and tetra-substituted olefins BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2004-07-22 — — 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-20040143125-A1 Synthesis of dihalohydrins and tri- and tetra-substituted olefins TALDO1, HDHD5, TKT TSHR 2809/4885CTRB1 500/4885PRSS1 3728/4885

“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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