SCHEMBL21993286

SCHEMBL21993286

O=c1c2ccc(Cl)cc2nc2n1CC/C2=C\c1ccc(OC(F)F)cc1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.65
▸ MEN1 O00255 5/20 0.65
▸ POLB P06746 1/20 0.60
▸ ALDH1A1 P00352 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ MCL1 Q07820 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL25053624 0.92 KMT2A (0.63) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL11082848 0.83 MEN1 (0.78) KMT2AMEN1POLB
SCHEMBL11082846 0.83 MEN1 (0.78) KMT2AMEN1POLB
SCHEMBL28045595 0.81 MEN1 (0.66) KMT2AMEN1POLB
SCHEMBL11079427 0.79 MEN1 (0.63) KMT2AMEN1POLB
SCHEMBL11079429 0.79 MEN1 (0.63) KMT2AMEN1POLB
SCHEMBL11088153 0.79 CCR3 (0.61) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL11088156 0.79 CCR3 (0.61) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL11084764 0.77 MEN1 (0.66) KMT2AMEN1POLB
SCHEMBL11084767 0.77 MEN1 (0.66) KMT2AMEN1POLB

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-11583530-B2 Compounds for the prevention and treatment of medical disorders and uses thereof GALECTIN SCIENCES, LLC (US) 2023-02-21 — — US disclosed
US-20200147088-A1 Compounds for the Prevention and Treatment of Medical Disorders and Uses Thereof GALECTIN SCIENCES, LLC 2020-05-14 — — 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-20200147088-A1 Compounds for the Prevention and Treatment of Medical Disorders and Uses Thereof LGALS1, LGALS2, LGALS3 KMT2A 4754/4885MEN1 523/4885POLB 4727/4885
US-11583530-B2 Compounds for the prevention and treatment of medical disorders and uses thereof LGALS1, LGALS2, LGALS3 KMT2A 4754/4885MEN1 523/4885POLB 4727/4885

“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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