SCHEMBL1600273

SCHEMBL1600273

CCOC(=O)C1(c2cc(O)cc(F)c2)CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.55
OPRM1 P35372 8/20 0.46
ALDH1A1 P00352 1/20 0.43
LMNA P02545 3/20 0.42
TSHR P16473 2/20 0.42
CYP2C19 P33261 1/20 0.42
OPRD1 P41143 4/20 0.40
OPRK1 P41145 4/20 0.40
SLC22A1 O15245 1/20 0.40
SLC6A4 P31645 1/20 0.40
ADRA1A P35348 1/20 0.40
KCNH2 Q12809 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL7809211 0.88 OPRM1 (0.49) ALOX5OPRM1LMNATSHROPRD1
SCHEMBL7809125 0.87 OPRM1 (0.48) ALOX5OPRM1LMNATSHROPRD1
SCHEMBL1599453 0.85 ALOX5 (0.41) ALOX5ALDH1A1LMNATSHRCYP2C19
SCHEMBL1625409 0.81 OPRM1 (0.67) OPRM1ALDH1A1LMNATSHRCYP2C19
SCHEMBL7809110 0.81 ALOX5 (0.47) ALOX5ALDH1A1LMNATSHRCYP2C19
SCHEMBL9136332 0.81 ALOX5 (0.54) ALOX5OPRM1ALDH1A1LMNATSHR
SCHEMBL7808973 0.80 ALOX5 (0.70) ALOX5OPRM1ALDH1A1LMNATSHR
SCHEMBL7807428 0.78 ALOX5 (0.47) ALOX5ALDH1A1LMNATSHRNPSR1
SCHEMBL9248765 0.76 ALOX5 (0.49) ALOX5
SCHEMBL9136244 0.75 ALOX5 (0.42) ALOX5OPRM1ALDH1A1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110112106-A1 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2011-05-12 US disclosed
US-7919621-B2 Tricyclic inhibitors of 5-lipoxygenase AMIRA PHARMACEUTICALS, INC. (US) 2011-04-05 US disclosed
EP-1978966-A2 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE Amira Pharmaceuticals, Inc. (US) 2008-10-15 EP disclosed
WO-2007087250-A2 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2007-08-02 WO disclosed
US-20070173508-A1 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2007-07-26 US disclosed
EP-0787127-B1 5-LIPOXYGENASE INHIBITORS PFIZER (US) 2001-01-03 EP disclosed
US-6063928-A ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, CARDIOTONIC AGENTS PFIZER INC (US) 2000-05-16 US disclosed
US-5883106-A 5-lipoxygenase inhibitors PFIZER INC. (US) 1999-03-16 US disclosed
EP-0787127-A1 5-LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1997-08-06 EP disclosed
WO-1996011911-A1 5-LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1996-04-25 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-20070173508-A1 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE ALOX5, ALOX15, ALOX15B ALOX5 1/4885OPRM1 1409/4885ALDH1A1 802/4885
US-20110112106-A1 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE ALOX5, ALOX15, ALOX15B ALOX5 1/4885OPRM1 1409/4885ALDH1A1 802/4885

“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.