SCHEMBL24437156

SCHEMBL24437156

Cc1cnccc1NC(=O)c1nn(CC2CC2)c2c1CCC2

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 11/20 0.40
▸ BRD4 O60885 8/20 0.40
▸ KDM4C Q9H3R0 1/20 0.38
▸ EP300 Q09472 3/20 0.38
▸ THRB P10828 1/20 0.38
▸ GRM5 P41594 1/20 0.38
▸ OPRM1 P35372 1/20 0.37
▸ OPRL1 P41146 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ RET P07949 2/20 0.36
▸ GSK3A P49840 1/20 0.36
▸ LCK P06239 1/20 0.35
▸ SRC P12931 1/20 0.35

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
SCHEMBL24437321 0.98 GRM5 (0.40) CREBBPBRD4KDM4CEP300THRB
SCHEMBL24437166 0.95 OPRM1 (0.40) CREBBPBRD4KDM4CEP300THRB
SCHEMBL24437333 0.89 WNT1 (0.39) CREBBPBRD4KDM4CEP300OPRM1
SCHEMBL24437314 0.84 KDM4C (0.40) CREBBPBRD4KDM4CGRM5OPRM1
SCHEMBL24437130 0.80 CNR1 (0.50) KDM4C
SCHEMBL24437128 0.78 CNR1 (0.53) KDM4COPRM1OPRL1
SCHEMBL24437152 0.74 NPC1 (0.44) KDM4COPRM1OPRL1GAAGSK3A
SCHEMBL24437308 0.69 KDM4C (0.57) KDM4C
SCHEMBL29601258 0.69 KDM4C (0.57) KDM4C
SCHEMBL24437163 0.67 CNR1 (0.51) THRB

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-12459938-B2 ORAI channel inhibitors BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2025-11-04 — — US disclosed
US-20220153735-A1 Orai Channel Inhibitors BETH ISRAEL DEACONESS MEDICAL CENTER, INC. 2022-05-19 — — US disclosed
US-20220153735-A1 Orai Channel Inhibitors BETH ISRAEL DEACONESS MEDICAL CENTER, INC. 2022-05-19 — — 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-12459938-B2 ORAI channel inhibitors ORAI1, CACNA1E, ORAI3 CREBBP 1995/4885BRD4 1522/4885KDM4C 2563/4885
US-20220153735-A1 Orai Channel Inhibitors ORAI2, ORAI1, ORAI3 CREBBP 1680/4885BRD4 2534/4885KDM4C 3959/4885

“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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