SCHEMBL2761782

SCHEMBL2761782

CC1(C)OC(=O)c2c(OCCCC3CCCC3)cccc2O1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 11/20 0.42
▸ CYSLTR2 Q9NS75 1/20 0.38
▸ CYSLTR1 Q9Y271 1/20 0.38
▸ PPARG P37231 2/20 0.38
▸ S1PR5 Q9H228 1/20 0.37
▸ IDO1 P14902 1/20 0.36
▸ EHMT2 Q96KQ7 1/20 0.36
▸ MCHR1 Q99705 1/20 0.36
▸ PTGES O14684 1/20 0.35

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
SCHEMBL12676736 0.93 IDO1 (0.43) HPGDPPARGIDO1MCHR1
SCHEMBL1948872 0.79 MCHR1 (0.39) IDO1MCHR1
SCHEMBL21012608 0.78 ALDH1A1 (0.38) —
SCHEMBL15349588 0.78 ALDH1A1 (0.38) —
SCHEMBL2761656 0.76 PTGS2 (0.40) HPGDMCHR1
SCHEMBL21957987 0.76 CHRNB4 (0.48) —
SCHEMBL22019558 0.76 CHEK2 (0.42) —
Hydrochloric Acid SCHEMBL21957985 0.75 CHRNB4 (0.47) —
SCHEMBL15349916 0.74 ALDH1A1 (0.39) IDO1
SCHEMBL12676731 0.74 HPGD (0.39) HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324405-B2 Chromene derivatives and use thereof as HIF hydroxylase activity inhibitors FIBROGEN, INC. (US) 2012-12-04 — — US disclosed
US-20100331400-A1 CHROMENE DERIVATIVES AND USE THEREOF AS HIF HYDROXYLASE ACTIVITY INHIBITORS FIBROGEN, INC. 2010-12-30 — — US disclosed
WO-2009100250-A1 CHROMENE DERIVATIVES AND USE THEREOF AS HIF HYDROXYLASE ACTIVITY INHIBITORS FIBROGEN, INC. (US) 2009-08-13 — — 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 (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-20100331400-A1 CHROMENE DERIVATIVES AND USE THEREOF AS HIF HYDROXYLASE ACTIVITY INHIBITORS HIF1AN, HIF1A, EGLN2 HPGD 37/4885CYSLTR2 3790/4885CYSLTR1 4074/4885

“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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