SCHEMBL18501464

SCHEMBL18501464

CC(=O)CCCc1cccc(Br)c1O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ IAPP P10997 4/20 0.56
▸ ALOX5 P09917 1/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ EGFR P00533 3/20 0.40
▸ CA2 P00918 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ GABRA1 P14867 1/20 0.38
▸ GABRB2 P47870 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ LMNA P02545 1/20 0.37
▸ ERBB2 P04626 2/20 0.36
▸ PRKCI P41743 1/20 0.36
▸ HMGB1 P09429 1/20 0.36
▸ BID P55957 2/20 0.36
▸ BCL2L1 Q07817 2/20 0.36
▸ MCL1 Q07820 2/20 0.36
▸ BAK1 Q16611 2/20 0.36

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
SCHEMBL31683730 0.85 MEN1 (0.47) IAPPEGFRERBB2HMGB1
SCHEMBL5182214 0.84 TAAR1 (0.47) IAPPALDH1A1LMNA
SCHEMBL7804267 0.83 IAPP (0.80) IAPPBIDBCL2L1MCL1BAK1
SCHEMBL14793053 0.83 ALOX5 (0.44) IAPPALOX5PTGS2EGFRCA2
SCHEMBL18501453 0.81 IAPP (0.57) IAPPALOX5PTGS2CA2GABRA1
SCHEMBL11164405 0.79 ALOX5 (0.57) IAPPALOX5PTGS2EGFRGABRA1
SCHEMBL16051902 0.77 ALOX5 (0.65) IAPPALOX5PTGS2EGFRERBB2
SCHEMBL27522264 0.77 FFAR1 (0.48) IAPPEGFRCA2ACHEERBB2
SCHEMBL29086100 0.77 IAPP (0.75) IAPPBIDBCL2L1MCL1BAK1
SCHEMBL29086130 0.77 IAPP (0.75) IAPPBIDBCL2L1MCL1BAK1

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-20180037563-A1 PROCESS FOR MAKING BERAPROST UNITED THERAPEUTICS CORPORATION (US) 2018-02-08 — — US disclosed
US-9765047-B2 Process for making beraprost UNITED THERAPEUTICS CORPORATION (US) 2017-09-19 — — US disclosed
US-20170044126-A1 PROCESS FOR MAKING BERAPROST UNITED THERAPEUTICS CORPORATION (US) 2017-02-16 — — 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 (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-20180037563-A1 PROCESS FOR MAKING BERAPROST DHPS, DDOST, COASY IAPP 1937/4885ALOX5 490/4885PTGS2 497/4885
US-20170044126-A1 PROCESS FOR MAKING BERAPROST DHPS, DDOST, COASY IAPP 1937/4885ALOX5 490/4885PTGS2 497/4885

“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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