SCHEMBL3749984

SCHEMBL3749984

C=C(C)C(=O)OC1C2OC(=O)C3(F)CC1C(C)(C)C23

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL3745571 0.82 KDM4E (0.31) KMT2AKDM4ENPC1POLBMAPT
SCHEMBL3755755 0.80 — —
SCHEMBL1218545 0.78 KDM4E (0.32) KDM4ENPC1POLBMAPTPKM
SCHEMBL1216386 0.74 KDM4E (0.31) KMT2AKDM4ENPC1POLBMAPT
SCHEMBL18720924 0.70 KDM4E (0.32) KMT2AKDM4ENPC1POLBMAPT
SCHEMBL685840 0.70 KDM4E (0.32) KMT2AKDM4ENPC1POLBMAPT
SCHEMBL3749948 0.68 KDM4E (0.31) KDM4ENPC1POLBMAPTPKM
SCHEMBL10027337 0.68 ABCB1 (0.32) —
SCHEMBL4818997 0.68 OPRM1 (0.30) —
SCHEMBL76320 0.68 KDM4E (0.32) KMT2AKDM4ENPC1POLBMAPT

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-8637623-B2 Monomer having electron-withdrawing substituent and lactone skeleton, polymeric compound, and photoresist composition DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2014-01-28 — — US disclosed
US-20100316954-A1 MONOMER HAVING LACTONE SKELETON, POLYMER COMPOUND AND PHOTORESIST COMPOSITION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-16 — — US disclosed
US-20100297555-A1 MONOMER HAVING ELECTRON-WITHDRAWING SUBSTITUENT AND LACTONE SKELETON, POLYMERIC COMPOUND, AND PHOTORESIST COMPOSITION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-11-25 — — 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-20100297555-A1 MONOMER HAVING ELECTRON-WITHDRAWING SUBSTITUENT AND LACTONE SKELETON, POLYMERIC COMPOUND, AND PHOTORESIST COMPOSITION DCXR, RPS10, RRS1 KMT2A 834/4885KDM4E 860/4885NPC1 4387/4885
US-20100316954-A1 MONOMER HAVING LACTONE SKELETON, POLYMER COMPOUND AND PHOTORESIST COMPOSITION RRS1, CNKSR1, LSS KMT2A 918/4885KDM4E 1628/4885NPC1 4646/4885

“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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