SCHEMBL18740201

SCHEMBL18740201

COC(=O)c1c(C(F)(F)F)nn2c1N(Cc1ccc(F)cc1)CC2

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ ALDH1A1 P00352 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ POLB P06746 1/20 0.39
▸ TP53 P04637 2/20 0.38
▸ PKM P14618 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.37
▸ HSP90B1 P14625 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ ATM Q13315 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36

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
SCHEMBL18740240 0.92 MEN1 (0.45) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18739965 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18740218 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18740289 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18740278 0.90 ALDH1A1 (0.53) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18758440 0.89 ALDH1A1 (0.45) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18740101 0.89 PKM (0.45) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18740062 0.88 MEN1 (0.44) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL18740177 0.86 MEN1 (0.43) MEN1KMT2AALDH1A1SMN1; SMN2POLB
SCHEMBL18740092 0.86 PKM (0.45) MEN1KMT2AALDH1A1SMN1; SMN2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11434246-B2 EP4 antagonists EISAI R&D MANAGEMENT CO., LTD. (JP) 2022-09-06 — — US disclosed
EP-3362454-B1 EP4 ANTAGONISTS EISAI R&D MAN CO LTD (JP) 2021-12-08 — — EP disclosed
US-20210347779-A1 EP4 ANTAGONISTS EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-11-11 — — US disclosed
US-20210347779-A1 EP4 ANTAGONISTS EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-11-11 — — US disclosed
CN-108473497-B EP4 antagonists 卫材R&D 管理有限公司 2021-09-10 — — CN disclosed
US-10941148-B2 EP4 antagonists EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-03-09 — — US disclosed
US-10941148-B2 EP4 antagonists EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-03-09 — — US disclosed
US-20190315754-A1 EP4 ANTAGONISTS EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-10-17 — — US disclosed
US-20190315754-A1 EP4 ANTAGONISTS EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-10-17 — — US disclosed
US-10316040-B2 EP4 antagonists EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-06-11 — — US disclosed
US-10316040-B2 EP4 antagonists EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-06-11 — — US disclosed
US-20180305362-A1 EP4 ANTAGONISTS EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-10-25 — — US disclosed
EP-3362454-A1 EP4 ANTAGONISTS Eisai R&D Management Co., Ltd. (JP) 2018-08-22 — — EP disclosed
WO-2017066633-A1 EP4 ANTAGONISTS EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-04-20 — — WO disclosed
WO-2017066633-A1 EP4 ANTAGONISTS EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-04-20 — — WO 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 (6 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-11434246-B2 EP4 antagonists PTGER4, PTGER3, PTGER1 MEN1 1667/4885KMT2A 3284/4885ALDH1A1 956/4885
US-20180305362-A1 EP4 ANTAGONISTS PTGER4, PTGER3, PTGER1 MEN1 1667/4885KMT2A 3284/4885ALDH1A1 956/4885
US-10316040-B2 EP4 antagonists PTGER4, PTGER3, PTGER1 MEN1 1667/4885KMT2A 3284/4885ALDH1A1 956/4885
US-10941148-B2 EP4 antagonists PTGER4, PTGER3, PTGER1 MEN1 1667/4885KMT2A 3284/4885ALDH1A1 956/4885
US-20190315754-A1 EP4 ANTAGONISTS PTGER4, PTGER3, PTGER1 MEN1 1667/4885KMT2A 3284/4885ALDH1A1 956/4885
US-20210347779-A1 EP4 ANTAGONISTS PTGER4, PTGER3, PTGER1 MEN1 1667/4885KMT2A 3284/4885ALDH1A1 956/4885

“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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