SCHEMBL21081513

SCHEMBL21081513

COC(=O)c1c(C(F)(F)F)nn2c1CCC2

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.46
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ TSHR P16473 3/20 0.39
▸ POLB P06746 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ LMNA P02545 5/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ PLAT P00750 1/20 0.38
▸ NPC1 O15118 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ GAA P10253 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL30323375 0.78 MAPK1 (0.49) MAPK1KMT2AMEN1POLBLMNA
SCHEMBL18740086 0.77 PLAT (0.40) MAPK1TSHRPOLBTP53PLAT
SCHEMBL30323467 0.76 BRD4 (0.45) MAPK1KMT2AMEN1
SCHEMBL23414986 0.74 ALDH1A1 (0.48) MAPK1KMT2AMEN1TSHRTP53
SCHEMBL31714739 0.74 ALDH1A1 (0.45) MAPK1KMT2AMEN1POLBLMNA
SCHEMBL18740020 0.73 PLAT (0.42) MAPK1POLBALDH1A1PLATNPC1
SCHEMBL29852457 0.72 ALDH1A1 (0.44) MAPK1KMT2AMEN1POLBTP53
SCHEMBL18740351 0.71 NOX4 (0.39) MAPK1KMT2AMEN1POLBLMNA
SCHEMBL31053388 0.70 ALDH1A1 (0.42) MAPK1KMT2AMEN1POLBTP53
SCHEMBL31158416 0.69 MAPK1 (0.42) MAPK1KMT2AMEN1POLBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10316040-B2 EP4 antagonists EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-06-11 — — 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 (1 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-10316040-B2 EP4 antagonists PTGER4, PTGER3, PTGER1 MAPK1 1927/4885KMT2A 3284/4885MEN1 1667/4885

“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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