SCHEMBL25110212

SCHEMBL25110212

CC(C)CCCOCCCNCc1ccc(N2CCN(C(C)C)CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ THRB P10828 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ HRH3 Q9Y5N1 3/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CXCR4 P61073 6/20 0.35
▸ NCF1 P14598 1/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ OPRD1 P41143 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ TSHR P16473 1/20 0.34

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
SCHEMBL24513990 0.94 KDM4E (0.41) KDM4EALDH1A1MAPTPKMTHRB
SCHEMBL24513989 0.94 KDM4E (0.41) KDM4EALDH1A1MAPTPKMTHRB
SCHEMBL22790759 0.88 KDM4E (0.42) KDM4EALDH1A1MAPTPKMTHRB
SCHEMBL25109776 0.86 HRH3 (0.46) KDM4EALDH1A1MAPTPKMTHRB
SCHEMBL22793930 0.85 KDM4E (0.43) KDM4EALDH1A1MAPTPKMTHRB
SCHEMBL22793929 0.84 KDM4E (0.42) KDM4EALDH1A1MAPTPKMTHRB
SCHEMBL24514674 0.84 NCF1 (0.45) KDM4ETHRBTDP1CXCR4NCF1
SCHEMBL25108854 0.83 KDM4E (0.39) KDM4EALDH1A1MAPTPKMTDP1
SCHEMBL25481170 0.83 KDM4E (0.34) KDM4EALDH1A1MAPTTHRBTDP1
SCHEMBL22790760 0.83 L3MBTL1 (0.35) KDM4EALDH1A1MAPTTHRBTDP1

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-20230072658-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-03-09 — — 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-20230072658-A1 SMARCA DEGRADERS AND USES THEREOF SMARCA1, SMARCB1, SMARCE1 KDM4E 624/4885ALDH1A1 3736/4885MAPT 1445/4885

“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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