SCHEMBL2811767

SCHEMBL2811767

COCCCOc1cc(CC2(NC(=O)O)CC2)c(Br)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 4/20 0.40
▸ CA2 P00918 4/20 0.40
▸ CA12 O43570 3/20 0.40
▸ CA9 Q16790 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ LMNA P02545 2/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ POLB P06746 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ LCK P06239 1/20 0.35
▸ FYN P06241 1/20 0.35
▸ MTNR1A P48039 1/20 0.35
▸ MTNR1B P49286 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
SCHEMBL2806187 0.87 LPAR1 (0.36) KDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL21327297 0.78 CYP2B6 (0.35) KDM4EUSP2KMT2A
SCHEMBL21327459 0.74 CYP2B6 (0.35) KDM4EUSP2KMT2AALDH1A1
SCHEMBL2811764 0.74 REN (0.49) CA1CA2CA12CA9KDM4E
SCHEMBL13132337 0.72 KMT2A (0.60) KDM4ELMNAKMT2AMEN1ALDH1A1
SCHEMBL1072077 0.70 KDM4E (0.35) KDM4EUSP2LMNASMN1; SMN2ALDH1A1
SCHEMBL3370500 0.69 L3MBTL1 (0.48) KDM4EUSP2LMNASMN1; SMN2KMT2A
SCHEMBL21331710 0.68 MAPT (0.43) KDM4EUSP2LMNASMN1; SMN2LCK
SCHEMBL2810161 0.68 REN (0.35) KDM4EUSP2ALDH1A1
SCHEMBL2812259 0.67 REN (0.43) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8975252-B2 Morpholine derivative SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-03-10 — — US disclosed
US-20100240644-A1 MORPHOLINE DERIVATIVE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2010-09-23 — — 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-20100240644-A1 MORPHOLINE DERIVATIVE REN, AGTR1, AGTR2 CA1 4330/4885CA2 1099/4885CA12 4571/4885

“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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