SCHEMBL23684362

SCHEMBL23684362

c1cc2c(cc1OCc1cnnn1C1CCCCO1)CCNC2

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 7/20 0.41
▸ CYP4F2 P78329 6/20 0.39
▸ CYP4A11 Q02928 6/20 0.39
▸ CD274 Q9NZQ7 1/20 0.38
▸ NOS3 P29474 1/20 0.38
▸ NOS1 P29475 1/20 0.38
▸ NOS2 P35228 1/20 0.38
▸ SLC2A1 P11166 1/20 0.35
▸ HRH1 P35367 1/20 0.34
▸ ASIC3 Q9UHC3 1/20 0.34
▸ ADRA2A P08913 1/20 0.33
▸ ADRA2B P18089 1/20 0.33
▸ ADRA2C P18825 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33

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
SCHEMBL23685064 0.81 HRH3 (0.43) HRH3CYP4F2CYP4A11CD274NOS3
SCHEMBL23684567 0.77 ESR1 (0.48) CYP4F2CYP4A11
SCHEMBL23683950 0.76 HRH3 (0.50) HRH3CD274NOS3NOS1NOS2
SCHEMBL22070632 0.71 CYP4F2 (0.66) CYP4F2CYP4A11
SCHEMBL8188548 0.69 HRH3 (0.43) HRH3CD274NOS3NOS1NOS2
SCHEMBL23684209 0.69 HRH3 (0.51) HRH3CD274NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL23684416 0.68 HRH3 (0.50) HRH3CD274NOS3NOS1NOS2
SCHEMBL23684595 0.67 ALDH1A1 (0.38) CYP4F2CYP4A11
SCHEMBL23684184 0.65 CD274 (0.47) HRH3CD274NOS3NOS1NOS2
SCHEMBL17585078 0.65 HRH3 (0.58) HRH3CD274NOS3NOS1NOS2

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
US-11986471-B2 Compounds and methods of use TANGO THERAPEUTICS, INC. (US) 2024-05-21 — — US disclosed
US-20230060499-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2023-03-02 — — US disclosed
US-11077101-B1 Compounds and methods of use TANGO THERAPEUTICS, INC. (US) 2021-08-03 — — US disclosed
US-11077101-B1 Compounds and methods of use TANGO THERAPEUTICS, INC. (US) 2021-08-03 — — 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 (3 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-11986471-B2 Compounds and methods of use XDH, F12, LPXN HRH3 183/4885CYP4F2 204/4885CYP4A11 66/4885
US-11077101-B1 Compounds and methods of use XDH, F12, LPXN HRH3 183/4885CYP4F2 204/4885CYP4A11 66/4885
US-20230060499-A1 COMPOUNDS AND METHODS OF USE XDH, F12, LPXN HRH3 183/4885CYP4F2 204/4885CYP4A11 66/4885

“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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