SCHEMBL9982691

SCHEMBL9982691

CCCCNc1cnn(C)c(=O)c1Cl

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.64
▸ RAB9A P51151 1/20 0.64
▸ SMN1; SMN2 Q16637 1/20 0.64
▸ KAT2B Q92831 9/20 0.59
▸ BRD9 Q9H8M2 5/20 0.59
▸ BRD4 O60885 8/20 0.58
▸ BPTF Q12830 7/20 0.51
▸ CNR2 P34972 3/20 0.51
▸ CNR1 P21554 1/20 0.48

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
SCHEMBL3250048 0.84 KAT2B (0.63) KAT2BBRD9BRD4BPTFCNR2
SCHEMBL9982965 0.79 BPTF (0.68) KDM4ERAB9ASMN1; SMN2KAT2BBRD9
SCHEMBL3247038 0.77 KAT2B (0.65) KAT2BBRD9BRD4BPTF
SCHEMBL8243863 0.73 RAB9A (0.91) KDM4ERAB9ASMN1; SMN2CNR2
SCHEMBL9527777 0.73 KAT2B (0.57) SMN1; SMN2KAT2BBRD9BRD4BPTF
SCHEMBL10366891 0.72 SMN1; SMN2 (0.51) KDM4ERAB9ASMN1; SMN2KAT2BBRD9
SCHEMBL7160804 0.72 KAT2B (0.74) KAT2BBRD9BRD4BPTF
SCHEMBL9528713 0.72 BRD4 (0.55) KAT2BBRD9BRD4
SCHEMBL9527132 0.72 KAT2B (0.49) KAT2BBRD9BRD4BPTFCNR2
SCHEMBL22749223 0.72 CNR2 (0.48) KDM4ERAB9ASMN1; SMN2CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2132188-B1 SUBSTITUTED PHENOXY N-ALKYLATED THIAZOLEDINEDIONE AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-12-14 — — EP claimed
US-8586596-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2013-11-19 — — US disclosed
WO-2011159785-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2011-12-22 — — WO disclosed
US-20110306616-A1 Novel Compounds as Cannabinoid Receptor Ligands ABBOTT LABORATORIES (US) 2011-12-15 — — 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-20110306616-A1 Novel Compounds as Cannabinoid Receptor Ligands CNR1, CNR2, GPR18 KDM4E 3114/4885RAB9A 866/4885SMN1; SMN2 3010/4885

“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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