SCHEMBL9998787

SCHEMBL9998787

C=C(C)C(=O)Oc1ccc(O)cc1.C=C(C)C(=O)Oc1ccc(OC(C)OC2Cc3cccc4cccc2c34)cc1.COC(=O)C1=CC2C=CC1C2

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 1/20 0.30

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
SCHEMBL16660472 0.83 MTNR1A (0.38) KMT2AMTNR1AMTNR1B
SCHEMBL12021547 0.69 MTNR1A (0.38) MTNR1AMTNR1B
SCHEMBL11964374 0.66 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL16660473 0.66 MTNR1A (0.41) KMT2AMTNR1AMTNR1B
SCHEMBL9999362 0.65 ELANE (0.43) KMT2A
SCHEMBL16660501 0.65 ELANE (0.47) KMT2AMTNR1AMTNR1B
SCHEMBL20306559 0.64 MTNR1A (0.48) MTNR1AMTNR1B
SCHEMBL2776949 0.64 MTNR1A (0.48) MTNR1AMTNR1B
SCHEMBL9999005 0.64 ELANE (0.34) KMT2A
SCHEMBL11964377 0.64 MTNR1A (0.35) MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110294070-A1 MONOMER, POLYMER, CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2011-12-01 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-20110294070-A1 MONOMER, POLYMER, CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION, AND PATTERNING PROCESS PARG, PCNA, POLH KMT2A 873/4885MTNR1A 4053/4885MTNR1B 4273/4885

“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.