SCHEMBL12379239

SCHEMBL12379239

CC=Cc1ccccc1OC(C)=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.52
▸ KMT2A Q03164 5/20 0.52
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ HSP90AA1 P07900 1/20 0.51
▸ KDM4E B2RXH2 3/20 0.50
▸ PTGS2 P35354 3/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ ESR1 P03372 1/20 0.50
▸ ITGB3 P05106 1/20 0.50
▸ ITGA2B P08514 1/20 0.50
▸ HMGB1 P09429 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ GGT1 P19440 1/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ BLM P54132 1/20 0.50
▸ NAPRT Q6XQN6 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL8291205 1.00 MEN1 (0.52) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL1603612 0.90 MEN1 (0.60) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL14775180 0.87 NFE2L2 (0.49) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL14775179 0.87 NFE2L2 (0.49) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL14775182 0.85 MEN1 (0.50) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL28212445 0.84 KDM4E (0.46) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL2096100 0.84 MEN1 (0.51) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL15330637 0.84 CDK4 (0.52) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL2096099 0.84 MEN1 (0.51) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL6475481 0.84 CDK4 (0.52) MEN1KMT2ANPC1RAB9AHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403854-B2 Cross-metathesis reaction of functionalized and substituted olefins using group 8 transition metal carbene complexes as metathesis catalysts CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2016-08-02 — — US disclosed
US-20140288319-A1 CROSS-METATHESIS REACTION OF FUNCTIONALIZED AND SUBSTITUTED OLEFINS USING GROUP 8 TRANSITION METAL CARBENE COMPLEXES AS METATHESIS CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2014-09-25 — — US disclosed
US-7989430-B2 Antibacterial agents REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2011-08-02 — — US disclosed
US-20080293666-A1 Antibacterial Agents REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2008-11-27 — — US disclosed
US-20070155975-A1 Cross-metathesis reaction of functionalized and substituted olefins using group 8 transition metal carbene complexes as metathesis catalysts CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2007-07-05 — — 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 (3 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-20140288319-A1 CROSS-METATHESIS REACTION OF FUNCTIONALIZED AND SUBSTITUTED OLEFINS USING GROUP 8 TRANSITION METAL CARBENE COMPLEXES AS METATHESIS CATALYSTS OXER1, OSTC, OXSR1 MEN1 2883/4885KMT2A 3700/4885NPC1 1679/4885
US-20070155975-A1 Cross-metathesis reaction of functionalized and substituted olefins using group 8 transition metal carbene complexes as metathesis catalysts OXER1, OSTC, OXSR1 MEN1 2883/4885KMT2A 3700/4885NPC1 1679/4885
US-20080293666-A1 Antibacterial Agents MRPL21, ABCB7, MSR1 MEN1 1924/4885KMT2A 4023/4885NPC1 1199/4885

“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.

Send feedback