SCHEMBL19980595

SCHEMBL19980595

OB(O)c1ccc2c(c1)C1(c3ccccc3-2)c2ccccc2-c2c1ccc1ccccc21

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
DNMT1 P26358 1/20 0.35
NSD2 O96028 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
HKDC1 Q2TB90 1/20 0.32
SOS1 Q07889 1/20 0.32
DHFR P00374 2/20 0.31
TYMS P04818 2/20 0.31

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
SCHEMBL30506451 1.00 CA1 (0.41) CA1CA2DNMT1NSD2OPRM1
SCHEMBL19511253 1.00 CA1 (0.41) CA1CA2DNMT1NSD2OPRM1
SCHEMBL20175791 0.92 CA1 (0.44) CA1CA2DNMT1NSD2OPRM1
SCHEMBL19974142 0.83 DNMT1 (0.43) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL19193652 0.83 CA1 (0.44) CA1CA2
SCHEMBL19193785 0.83 CA1 (0.44) CA1CA2
SCHEMBL38654388 0.83 CA1 (0.44) CA1CA2
SCHEMBL29473425 0.83 DNMT1 (0.43) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL29602907 0.83 CA1 (0.44) CA1CA2
SCHEMBL29533112 0.83 CA1 (0.44) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512841-B1 COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES MERCK PATENT GMBH (DE) 2023-04-26 EP disclosed
US-11447464-B2 Compounds with spirobifluorene-structures MERCK PATENT GMBH (DE) 2022-09-20 US disclosed
US-20190194164-A1 COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES MERCK PATENT GMBH (DE) 2019-06-27 US disclosed
WO-2018050584-A1 COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES MERCK PATENT GMBH (DE) 2018-03-22 WO 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 (2 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-11447464-B2 Compounds with spirobifluorene-structures SLCO1B3, SLCO4C1, SLCO1B1 CA1 4189/4885CA2 2295/4885DNMT1 1289/4885
US-20190194164-A1 COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES SLCO1B3, SLCO4C1, SLCO1B1 CA1 4189/4885CA2 2295/4885DNMT1 1289/4885

“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.