SCHEMBL21362848

SCHEMBL21362848

OCC(NCc1ccccc1)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.48
EPHX1 P07099 1/20 0.48
CD274 Q9NZQ7 1/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
EPHX2 P34913 1/20 0.44
TRPV3 Q8NET8 3/20 0.44
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTT P42858 1/20 0.43
METTL3 Q86U44 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGB1 P05556 1/20 0.41
ITGAV P06756 1/20 0.41
ITGA5 P08648 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
USP2 O75604 1/20 0.41
ALOX12 P18054 1/20 0.40

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
SCHEMBL27308031 0.95 HPGD (0.45) HPGDEPHX1CD274RAB9ANPC1
SCHEMBL26125032 0.92 SIGMAR1 (0.42) HPGDEPHX1CD274TRPV3ALDH1A1
SCHEMBL16726956 0.84 USP2 (0.38) HPGDCD274TRPV3ALDH1A1KMT2A
SCHEMBL8644471 0.84 GBA1 (0.44)
SCHEMBL5172580 0.80 HPGD (0.50) HPGDEPHX1RAB9ANPC1EPHX2
SCHEMBL18886611 0.80 EPHX1 (0.49) HPGDEPHX1RAB9ANPC1EPHX2
SCHEMBL23004863 0.79 NPC1 (0.47) HPGDEPHX1RAB9ANPC1EPHX2
SCHEMBL8091688 0.79 EPHX1 (0.40) HPGDEPHX1RAB9ANPC1EPHX2
SCHEMBL24324182 0.78 SIGMAR1 (0.40) HPGDEPHX2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL23004957 0.78 NPC1 (0.49) HPGDEPHX1RAB9ANPC1EPHX2

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
CN-109219601-B Method for preparing optically active beraprost 奇诺因药物和化学工厂私人有限公司 2022-08-09 CN disclosed
EP-3440065-B1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE BERAPROST EUROAPI HUNGARY LLC (HU) 2022-06-08 EP disclosed
US-10421737-B2 Process for the preparation of optically active Beraprost CHINOIN PHARMACEUTICAL AND CHEMICAL WORKS PRIVATE COMPANY LTD. (HU) 2019-09-24 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-10421737-B2 Process for the preparation of optically active Beraprost CYP51A1, DDOST, SQLE HPGD 937/4885EPHX1 152/4885CD274 3719/4885

“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.