SCHEMBL29720341

SCHEMBL29720341

CC1(C)c2cc(N3CC(F)(F)C3)ccc2C2(OC(=O)c3ccc(C(=O)NCCOCCOCCCCCCCl)cc32)c2ccc(N3CC(F)(F)C3)cc21

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.34
▸ NT5E P21589 1/20 0.34
▸ OPRM1 P35372 1/20 0.33
▸ PDE4B Q07343 1/20 0.32
▸ KLKB1 P03952 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ RORC P51449 1/20 0.31
▸ TLR2 O60603 2/20 0.30
▸ TP53 P04637 1/20 0.30
▸ MDM2 Q00987 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ IP6K1 Q92551 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
SCHEMBL18526377 1.00 KCNH2 (0.34) KCNH2NT5EOPRM1PDE4BKLKB1
SCHEMBL18526372 0.92 OPRM1 (0.37) KCNH2NT5EOPRM1HDAC6HPGD
SCHEMBL18526325 0.91 NT5E (0.40) KCNH2NT5EOPRM1PDE4BKLKB1
SCHEMBL22416866 0.85 TLR2 (0.41) NT5EOPRM1HPGDTLR2TP53
SCHEMBL18526322 0.82 NT5E (0.41) KCNH2NT5EOPRM1HDAC6RORC
SCHEMBL31696933 0.82 NT5E (0.37) KCNH2NT5EOPRM1PDE4BHDAC6
SCHEMBL18526374 0.82 OPRM1 (0.36) KCNH2NT5EOPRM1HDAC6HPGD
SCHEMBL29406990 0.82 OPRM1 (0.36) KCNH2NT5EOPRM1HDAC6HPGD
SCHEMBL31476377 0.81 KCNH2 (0.36) KCNH2NT5EOPRM1HDAC6RORC
SCHEMBL29720293 0.81 NT5E (0.35) KCNH2NT5EOPRM1PDE4BHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12474345-B2 Chemigenetic voltage indicators HOWARD HUGHES MEDICAL INSTITUTE (US) 2025-11-18 — — US disclosed
US-12440581-B2 Fluorophores for super-resolution imaging HOWARD HUGHES MEDICAL INSTITUTE (US) 2025-10-14 — — US disclosed
US-12275767-B2 Chemigenetic calcium indicators HOWARD HUGHES MEDICAL INSTITUTE (US) 2025-04-15 — — US disclosed
EP-4519426-A2 SPLIT MODIFIED DEHALOGENASE VARIANTS PROMEGA CORPORATION (US) 2025-03-12 — — EP disclosed
US-12105122-B2 Voltage indicators HOWARD HUGHES MEDICAL INSTITUTE (US) 2024-10-01 — — US disclosed
US-20240174992-A1 SPLIT MODIFIED DEHALOGENASE VARIANTS PROMEGA CORPORATION 2024-05-30 — — US disclosed
US-20230416320-A1 CHEMIGENETIC CALCIUM INDICATORS HOWARD HUGHES MEDICAL INSTITUTE 2023-12-28 — — US disclosed
WO-2023215452-A2 SPLIT MODIFIED DEHALOGENASE VARIANTS PROMEGA CORPORATION (US) 2023-11-09 — — WO disclosed
US-20230296649-A1 VOLTAGE INDICATORS HOWARD HUGHES MEDICAL INSTITUTE 2023-09-21 — — US disclosed
US-11708397-B2 Chemigenetic calcium indicators HOWARD HUGHES MEDICAL INSTITUTE (US) 2023-07-25 — — US disclosed
US-11598792-B2 Voltage indicators HOWARD HUGHES MEDICAL INSTITUTE (US) 2023-03-07 — — US disclosed
US-20220299518-A1 CHEMIGENETIC VOLTAGE INDICATORS HOWARD HUGHES MEDICAL INSTITUTE 2022-09-22 — — US disclosed
US-11385236-B2 Chemigenetic voltage indicators HOWARD HUGHES MEDICAL INSTITUTE (US) 2022-07-12 — — 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 (4 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-12474345-B2 Chemigenetic voltage indicators CACNB2, CACNB3, CACNB1 KCNH2 151/4885NT5E 2048/4885OPRM1 2872/4885
US-11385236-B2 Chemigenetic voltage indicators CACNB2, CACNB3, CACNB1 KCNH2 151/4885NT5E 2048/4885OPRM1 2872/4885
US-20220299518-A1 CHEMIGENETIC VOLTAGE INDICATORS CACNB2, CACNB3, CACNB1 KCNH2 151/4885NT5E 2048/4885OPRM1 2872/4885
US-12440581-B2 Fluorophores for super-resolution imaging CHAT, FABP7, CD68 KCNH2 3377/4885NT5E 1555/4885OPRM1 869/4885

“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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