SCHEMBL21765173

SCHEMBL21765173

CCOC(=O)Cn1cc(-c2ccccc2Nc2ccc(C(F)(F)F)cc2)nn1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.43
▸ IRAK4 Q9NWZ3 1/20 0.43
▸ DHODH Q02127 1/20 0.43
▸ FLT1 P17948 1/20 0.40
▸ KDR P35968 1/20 0.40
▸ FPR2 P25090 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ DDX3X O00571 1/20 0.40
▸ ABCG2 Q9UNQ0 5/20 0.39
▸ PPARG P37231 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ MDM2 Q00987 1/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL20552312 0.90 CACNA1B (0.47) IRAK4NPSR1
SCHEMBL25786437 0.85 IRAK4 (0.43) MAPK14IRAK4NPSR1
SCHEMBL20551922 0.83 TRPM2 (0.41) DHODHFPR2MAPTDDX3XABCG2
SCHEMBL20552711 0.83 FLT1 (0.47) FLT1KDR
SCHEMBL20551791 0.83 RAB9A (0.45) DHODHFPR2MAPTPPARGNPSR1
SCHEMBL20552657 0.83 JAK1 (0.43) DHODHFPR2MAPT
SCHEMBL20552417 0.81 MAPT (0.55) MAPTABCG2MAPK1NPSR1
SCHEMBL21749306 0.80 FLT1 (0.46) MAPK14FLT1KDRABCG2MDM2
SCHEMBL20552438 0.78 SMN1; SMN2 (0.46) DHODHFPR2MAPTPPARGNPSR1
SCHEMBL20552924 0.77 KMT2A (0.43) DHODHFPR2MAPTNPSR1

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-11186554-B2 Non-fused tricyclic compounds VIVACE THERAPEUTICS, INC. (US) 2021-11-30 — — US disclosed
US-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-02-27 — — 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-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS YAP1, MYC, TEAD2 MAPK14 2295/4885IRAK4 2748/4885DHODH 3053/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 MAPK14 2295/4885IRAK4 2748/4885DHODH 3053/4885

“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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