SCHEMBL3362406

SCHEMBL3362406

C[C@]12C[C@@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.76
▸ NR3C2 P08235 4/20 0.76
▸ HSD11B2 P80365 3/20 0.76
▸ HSD11B1 P28845 2/20 0.76
▸ HIF1A Q16665 7/20 0.72
▸ LMNA P02545 6/20 0.72
▸ HSD17B10 Q99714 6/20 0.72
▸ SHBG P04278 5/20 0.72
▸ SERPINA6 P08185 5/20 0.72
▸ CYP3A4 P08684 4/20 0.72
▸ TSHR P16473 3/20 0.72
▸ SIGMAR1 Q99720 3/20 0.72
▸ MAPT P10636 3/20 0.72
▸ MAPK1 P28482 2/20 0.72
▸ NFKB1 P19838 2/20 0.72
▸ BLM P54132 1/20 0.72
▸ CYP2C9 P11712 1/20 0.72
▸ SLC22A2 O15244 1/20 0.72
▸ SLC22A1 O15245 1/20 0.72
▸ SLC22A3 O75751 1/20 0.72

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
SCHEMBL20058563 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL13752954 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL10185506 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL15920491 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL619054 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL24900243 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL14525631 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL20058468 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL619055 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A
SCHEMBL3235812 1.00 SMN1; SMN2 (0.76) SMN1; SMN2NR3C2HSD11B2HSD11B1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040106216-A1 Method of measuring drug-metabolizing enzyme activity, method of evaluating inhibition of drug-metabolizing enzyme activity, and composition for these methods TOYO BOSEKI KABUSHIKI KAISHA (JP) 2004-06-03 — — US claimed
EP-1378751-A2 Method of measuring drug-metabolizing enzyme activity, method of evaluating inhibition of drug-metabolizing enzyme activity, and composition for these methods Toyo Boseki Kabushiki Kaisha (JP) 2004-01-07 — — EP claimed
US-11254924-B2 Method for biocatalysis using filamentous fungi THE UNIVERSITY OF THE WEST INDIES (JM) 2022-02-22 — — US disclosed
US-11254924-B2 Method for biocatalysis using filamentous fungi THE UNIVERSITY OF THE WEST INDIES (JM) 2022-02-22 — — US disclosed
US-20220041687-A1 A GROUP OF CHIMERIC ANTIGEN RECEPTORS (CARS) ST. ANNA KINDERKREBSFORSCHUNG (AT) 2022-02-10 — — US disclosed
US-20210386781-A1 A GROUP OF CHIMERIC ANTIGEN RECEPTORS (CARS) UNIVERSITÄT FÜR BODENKULTUR WIEN (AT) 2021-12-16 — — US disclosed
US-11130890-B2 Adhesive composition, adhesive sheet, and method for producing same TOYO INK SC HOLDINGS CO., LTD. (JP) 2021-09-28 — — US disclosed
EP-3632460-A1 A GROUP OF CHIMERIC ANTIGEN RECEPTORS (CARS) St. Anna Kinderkrebsforschung (AT) 2020-04-08 — — EP disclosed
EP-3632461-A1 A GROUP OF CHIMERIC ANTIGEN RECEPTORS (CARS) St. Anna Kinderkrebsforschung (AT) 2020-04-08 — — EP disclosed
US-20180044562-A1 ADHESIVE COMPOSITION, ADHESIVE SHEET, AND METHOD FOR PRODUCING SAME TOYO INK SC HOLDINGS CO., LTD. (JP) 2018-02-15 — — US disclosed
CN-106458922-A Affinity medicant conjugates AF化学药品有限责任公司 2017-02-22 — — CN disclosed
EP-2093285-B1 Method for biocatalysis using filamentous fungi UNIV THE WEST INDIES (JM) 2016-07-06 — — EP disclosed
US-20100189795-A1 CALCIUM SEQUESTRATION COMPOSITIONS AND METHODS OF TREATING SKIN PIGMENTATION DISORDERS AND CONDITIONS NEOCUTIS S.A. (CH) 2010-07-29 — — US disclosed
US-20090246850-A1 METHOD FOR BIOCATALYSIS USING FILAMENTOUS FUNGI UNIVERSITY OF THE WEST INDIES, A REGIONAL INSTITUTION, ESTABLISHED BY ROYAL CHARTER (JM) 2009-10-01 — — US disclosed
US-20090246850-A1 METHOD FOR BIOCATALYSIS USING FILAMENTOUS FUNGI UNIVERSITY OF THE WEST INDIES, A REGIONAL INSTITUTION, ESTABLISHED BY ROYAL CHARTER (JM) 2009-10-01 — — US disclosed
US-20090246850-A1 METHOD FOR BIOCATALYSIS USING FILAMENTOUS FUNGI UNIVERSITY OF THE WEST INDIES, A REGIONAL INSTITUTION, ESTABLISHED BY ROYAL CHARTER (JM) 2009-10-01 — — US disclosed
EP-2093285-A1 Method for biocatalysis using filamentous fungi The University of the West Indies (JM) 2009-08-26 — — EP disclosed
US-4874696-A FROM ALCALIGENES; MEDICAL DIAGNOSIS THE JOHNS HOPKINS UNIVERSITY, MED SCHOOL (US) 1989-10-17 — — US disclosed
US-4013688-A STEROIDS THE UPJOHN COMPANY (US) 1977-03-22 — — 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 (3 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-20100189795-A1 CALCIUM SEQUESTRATION COMPOSITIONS AND METHODS OF TREATING SKIN PIGMENTATION DISORDERS AND CONDITIONS S100A4, TYR, CACYBP SMN1; SMN2 2691/4885NR3C2 2672/4885HSD11B2 3357/4885
US-20220041687-A1 A GROUP OF CHIMERIC ANTIGEN RECEPTORS (CARS) CARS1, CD74, HAVCR2 SMN1; SMN2 4302/4885NR3C2 3966/4885HSD11B2 4412/4885
US-20210386781-A1 A GROUP OF CHIMERIC ANTIGEN RECEPTORS (CARS) CD74, HAVCR2, CD2BP2 SMN1; SMN2 4079/4885NR3C2 4049/4885HSD11B2 4631/4885

“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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