SCHEMBL17040284

SCHEMBL17040284

CC(=O)NC[C@@H]1CN(c2ccc(-c3ccc(NC(=O)c4cccnc4)nc3)c(F)c2)C(=O)O1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 8/20 0.55
▸ CALML3 P27482 4/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ MAOB P27338 3/20 0.50
▸ LMNA P02545 1/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ SDHA P31040 1/20 0.50
▸ CYP2C19 P33261 1/20 0.47

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
SCHEMBL6612901 1.00 MAOA (0.55) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL6791790 0.88 MAOA (0.64) MAOACALML3CYP3A4MAOBLMNA
SCHEMBL6612909 0.87 CALML3 (0.51) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL8484607 0.86 MAOA (0.66) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL7949645 0.86 MAOA (0.66) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL1393667 0.85 MAOA (0.54) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL6796433 0.85 MAOA (0.61) MAOACALML3CYP3A4MAOBLMNA
SCHEMBL6612431 0.85 MAOA (0.61) MAOACALML3CYP3A4MAOBLMNA
SCHEMBL6613809 0.85 MAOA (0.64) MAOACALML3CYP3A4MAOBLMNA
SCHEMBL6613234 0.84 MAOA (0.60) MAOACALML3CYP3A4MAOBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220008395-A1 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS FROST BIOLOGIC, INC. 2022-01-13 — — US disclosed
US-11129813-B2 Antimitotic amides for the treatment of cancer and proliferative disorders FROST BIOLOGIC, INC. (US) 2021-09-28 — — US disclosed
US-20200397758-A1 Antimitotic Amides for the Treatment of Cancer and Proliferative Disorders FROST BIOLOGIC, INC. 2020-12-24 — — US disclosed
US-10772872-B2 Antimitotic amides for the treatment of cancer and proliferative disorders FROST BIOLOGIC, INC. (US) 2020-09-15 — — US disclosed
US-10016398-B2 Antimitotic amides for the treatment of cancer and proliferative disorders FROST BIOLOGIC, INC. (US) 2018-07-10 — — US disclosed
US-10016398-B2 Antimitotic amides for the treatment of cancer and proliferative disorders FROST BIOLOGIC, INC. (US) 2018-07-10 — — US disclosed
US-20170172984-A1 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS FROST BIOLOGIC, INC. (US) 2017-06-22 — — US disclosed
US-20170172984-A1 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS FROST BIOLOGIC, INC. (US) 2017-06-22 — — US disclosed
WO-2015127284-A2 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS FROST BIOLOGIC, INC. (US) 2015-08-27 — — 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-20220008395-A1 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS CCNA1, CCNE1, CCNB1 MAOA 3235/4885CALML3 2787/4885CYP3A4 3673/4885
US-10016398-B2 Antimitotic amides for the treatment of cancer and proliferative disorders CCNA1, CCNE1, CCNB1 MAOA 3235/4885CALML3 2787/4885CYP3A4 3673/4885
US-11129813-B2 Antimitotic amides for the treatment of cancer and proliferative disorders CCNA1, CCNE1, CCNB1 MAOA 3235/4885CALML3 2787/4885CYP3A4 3673/4885
US-10772872-B2 Antimitotic amides for the treatment of cancer and proliferative disorders CCNA1, CCNE1, CCNB1 MAOA 3235/4885CALML3 2787/4885CYP3A4 3673/4885
US-20200397758-A1 Antimitotic Amides for the Treatment of Cancer and Proliferative Disorders CCNA1, CCNE1, CCNB1 MAOA 3235/4885CALML3 2787/4885CYP3A4 3673/4885
US-20170172984-A1 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS CCNA1, CCNE1, CCNB1 MAOA 3235/4885CALML3 2787/4885CYP3A4 3673/4885

“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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