SCHEMBL503339

SCHEMBL503339

CC12CC3CC(C1)CC(CC(=O)O)(C3)C2

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.64
ALDH1A1 P00352 5/20 0.54
TSHR P16473 2/20 0.54
GAA P10253 1/20 0.51
LMNA P02545 1/20 0.48
THRB P10828 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL7588383 1.00 POLB (0.64) POLBALDH1A1TSHRGAALMNA
Hydrochloric Acid SCHEMBL10532450 0.98 POLB (0.62) POLBALDH1A1TSHRGAALMNA
SCHEMBL14433714 0.86 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL29838840 0.86 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL14493662 0.86 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL1058665 0.86 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL13589979 0.86 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL10532442 0.85 GAA (0.51) POLBALDH1A1TSHRGAATHRB
SCHEMBL1786642 0.83 MEN1 (0.53) POLBALDH1A1TSHRLMNAMEN1
SCHEMBL14341836 0.81 POLB (0.64) POLBALDH1A1TSHRGAALMNA

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120318969-A1 METHOD FOR THE DIFFERENTIATION OF ALTERNATIVE SOURCES OF NAPHTHENIC ACIDS UNIVERSITY OF PLYMOUTH (GB) 2012-12-20 US claimed
EP-0653065-B1 SEPARATION METHOD MARCONI OPTICAL COMPONENTS LTD (GB) 2002-10-30 EP claimed
EP-0660935-B1 IMMUNOLOGICAL DETECTION USING TWO DETECTABLE LABELS MARCONI GEC LTD (GB) 2000-05-24 EP claimed
US-5723304-A Immunological detection using two detectable labels GEC-MARCONI LIMITED (GB) 1998-03-03 US claimed
EP-0660935-A1 IMMUNOLOGICAL DETECTION USING TWO DETECTABLE LABELS GEC-MARCONI LIMITED (GB) 1995-07-05 EP claimed
EP-0653065-A1 SEPARATION METHOD GEC-MARCONI LIMITED (GB) 1995-05-17 EP claimed
WO-1994003807-A1 SEPARATION METHOD GEC-MARCONI LIMITED (GB) 1994-02-17 WO claimed
WO-1994003811-A1 IMMUNOLOGICAL DETECTION USING TWO DETECTABLE LABELS GEC-MARCONI LIMITED (GB) 1994-02-17 WO claimed
JP-11040464-A None JP disclosed
US-20210353652-A1 TUMOR MICROENVIRONMENT-ACTIVATED DRUG-BINDER CONJUGATES, AND USES RELATED THERETO AVACTA LIFE SCIENCES, LIMITED (GB) 2021-11-18 US disclosed
US-20140147794-A1 METHOD OF FORMING PHOTORESIST PATTERN JSR CORPORATION (JP) 2014-05-29 US disclosed
US-8535872-B2 Thermally cured underlayer for lithographic application FUJIFILM ELECTRONIC MATERIALS, U.S.A., INC. (US) 2013-09-17 US disclosed
US-8481016-B2 Method for inhibition of potential-dependent cation channel KAO CORPORATION (JP) 2013-07-09 US disclosed
US-8435718-B2 Upper layer-forming composition and photoresist patterning method JSR CORPORATION (JP) 2013-05-07 US disclosed
WO-1992000995-A1 CYCLIC CELL ADHESION MODULATION COMPOUNDS TANABE SEIYAKU CO. LTD. (JP) 1992-01-23 WO disclosed
EP-0421802-A2 3-substituted-1,4-benzodiazepines useful as oxytocin antagonists MERCK & CO. INC. (US) 1991-04-10 EP disclosed
US-4781977-A WATER-INSOLUBLE RESIN-SPACER-LIGAND SANRAKU INCORPORATED (JP) 1988-11-01 US disclosed
EP-0220719-A2 Cyclodextrin absorbing material and its use Sanraku Incorporated (JP) 1987-05-06 EP disclosed
US-4349552-A TREATMENT OF CANCER FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1982-09-14 US disclosed
EP-0010941-B1 5-FLUOROURACIL DERIVATIVES, PREPARATION THEREOF AND THEIR PHARMACEUTICAL COMPOSITIONS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-05-12 EP 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-20210353652-A1 TUMOR MICROENVIRONMENT-ACTIVATED DRUG-BINDER CONJUGATES, AND USES RELATED THERETO CD47, VCAM1, CD44 POLB 4129/4885ALDH1A1 1284/4885TSHR 2415/4885

“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.