SCHEMBL19700189

SCHEMBL19700189

Cc1ccc2c(c1)CN(c1ccc([N+](=O)[O-])c(N)c1F)C2

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MAPT P10636 7/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ LMNA P02545 4/20 0.37
▸ POLB P06746 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ SIRT6 Q8N6T7 1/20 0.37
▸ MAPK1 P28482 3/20 0.36
▸ PKM P14618 1/20 0.36
▸ EED O75530 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL19690428 0.88 RAB9A (0.46) MAPTALDH1A1RAB9ALMNAPOLB
SCHEMBL19690305 0.83 MAPT (0.45) CYP3A4MAPTALDH1A1RAB9ALMNA
SCHEMBL19690481 0.79 RAB9A (0.56) MAPTALDH1A1RAB9ALMNAPOLB
SCHEMBL19690296 0.79 RAB9A (0.56) MAPTALDH1A1RAB9ALMNAPOLB
SCHEMBL2892379 0.77 MAPT (0.55) TSHRMAPTALDH1A1RAB9ALMNA
SCHEMBL19690307 0.75 LMNA (0.46) CYP3A4MAPTALDH1A1RAB9ALMNA
SCHEMBL19690477 0.75 LMNA (0.46) CYP3A4MAPTALDH1A1RAB9ALMNA
SCHEMBL939398 0.74 ALDH1A1 (0.68) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL21031716 0.73 ALDH1A1 (0.67) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL16599621 0.67 TSHR (0.52) TSHRCYP3A4MAPTALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11858900-B2 Fluorinated 2-amino-4-(substituted amino)phenyl carbamate derivatives OCUTERRA THERAPEUTICS, INC. (US) 2024-01-02 — — US disclosed
US-20170355679-A1 FLUORINATED 2-AMINO-4-(SUBSTITUTED AMINO)PHENYL CARBAMATE DERIVATIVES SCIFLUOR LIFE SCIENCES, INC. 2017-12-14 — — 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-20170355679-A1 FLUORINATED 2-AMINO-4-(SUBSTITUTED AMINO)PHENYL CARBAMATE DERIVATIVES KCNQ2, KCNQ1, KCNQ3 TSHR 3251/4885CYP3A4 929/4885MAPT 2123/4885
US-11858900-B2 Fluorinated 2-amino-4-(substituted amino)phenyl carbamate derivatives KCNQ2, KCNQ1, KCNQ3 TSHR 3251/4885CYP3A4 929/4885MAPT 2123/4885

“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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