SCHEMBL25413737

SCHEMBL25413737

Oc1cc(Cl)cc2c1cnn2C1CCCCO1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.44
▸ RXRB P28702 1/20 0.44
▸ RXRG P48443 1/20 0.44
▸ CYP4F2 P78329 2/20 0.42
▸ CYP4A11 Q02928 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ DGAT2 Q96PD7 1/20 0.35
▸ ATR Q13535 3/20 0.33
▸ YTHDC1 Q96MU7 1/20 0.33
▸ SPR P35270 1/20 0.33
▸ PDE9A O76083 2/20 0.33
▸ PDE1A P54750 1/20 0.33
▸ PDE1B Q01064 1/20 0.33
▸ PDE1C Q14123 1/20 0.33
▸ GRM1 Q13255 1/20 0.33
▸ RET P07949 1/20 0.32
▸ IDH1 O75874 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL29003306 0.84 RXRA (0.44) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL29561854 0.84 RXRA (0.42) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21196196 0.84 CYP4F2 (0.45) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL30950246 0.84 CYP4F2 (0.45) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL17731741 0.84 RXRA (0.42) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL20938994 0.84 RXRA (0.41) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL30602777 0.84 RXRA (0.41) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL30811759 0.84 RXRA (0.47) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL19915965 0.81 RXRA (0.40) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL19915969 0.81 RXRA (0.54) RXRARXRBRXRGCYP4F2CYP4A11

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-20250250237-A1 ALKYLAMINE OR HETEROALKYLAMINE DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASES (NOS), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF Gacter Inc. (US) 2025-08-07 — — US disclosed
US-20230286913-A1 INHIBITORS OF NITRIC OXIDE SYNTHASES (NOS), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF Gacter Inc. (US) 2023-09-14 — — US disclosed
US-20230286913-A1 INHIBITORS OF NITRIC OXIDE SYNTHASES (NOS), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF Gacter Inc. (US) 2023-09-14 — — US disclosed
US-20230286913-A1 INHIBITORS OF NITRIC OXIDE SYNTHASES (NOS), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF Gacter Inc. (US) 2023-09-14 — — 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-20250250237-A1 ALKYLAMINE OR HETEROALKYLAMINE DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASES (NOS), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF NOS3, NOS2, NOS1 RXRA 3161/4885RXRB 3265/4885RXRG 3350/4885
US-20230286913-A1 INHIBITORS OF NITRIC OXIDE SYNTHASES (NOS), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF NOS1, NOS3, NOS2 RXRA 2731/4885RXRB 2347/4885RXRG 2716/4885

“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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