SCHEMBL16225956

SCHEMBL16225956

C[C@H](C(O)CO)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CCC4(C)C3CC(O)C12C

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPBAR1 Q8TDU6 11/20 0.65
▸ SLC10A2 Q12908 2/20 0.65
▸ TBXA2R P21731 1/20 0.65
▸ PDE3A Q14432 1/20 0.65
▸ NR1H4 Q96RI1 1/20 0.65
▸ LMNA P02545 4/20 0.62
▸ MAPT P10636 2/20 0.62
▸ MAPK1 P28482 2/20 0.62
▸ MEN1 O00255 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ USP2 O75604 1/20 0.62
▸ ABCC4 O15439 1/20 0.54
▸ HSD17B10 Q99714 2/20 0.52
▸ SHBG P04278 1/20 0.52
▸ SERPINA6 P08185 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52

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
SCHEMBL19705510 0.89 GPBAR1 (0.74) GPBAR1SLC10A2TBXA2RPDE3ANR1H4
SCHEMBL19705677 0.89 GPBAR1 (0.74) GPBAR1SLC10A2TBXA2RPDE3ANR1H4
SCHEMBL19705511 0.89 GPBAR1 (0.74) GPBAR1SLC10A2TBXA2RPDE3ANR1H4
SCHEMBL10884448 0.87 GPBAR1 (0.73) GPBAR1SLC10A2TBXA2RPDE3ANR1H4
SCHEMBL16227102 0.85 GPBAR1 (0.70) GPBAR1PDE3ANR1H4LMNAMEN1
SCHEMBL16226417 0.84 GPBAR1 (0.77) GPBAR1SLC10A2TBXA2RPDE3ANR1H4
SCHEMBL16227156 0.84 GPBAR1 (0.77) GPBAR1SLC10A2TBXA2RPDE3ANR1H4
SCHEMBL4279494 0.84 GPBAR1 (0.68) GPBAR1SLC10A2TBXA2RPDE3ANR1H4
SCHEMBL20008824 0.84 MAPT (0.62) GPBAR1SLC10A2TBXA2RPDE3ANR1H4
SCHEMBL4279489 0.84 GPBAR1 (0.68) GPBAR1SLC10A2TBXA2RPDE3ANR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 — — 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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER IL2RA, CD74, IL2 GPBAR1 77/4885SLC10A2 3818/4885TBXA2R 60/4885

“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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