SCHEMBL21466561

SCHEMBL21466561

COc1ccc2[nH]cc(C[C@H](CN3C(=O)c4ccccc4C3=O)NC(=O)OC(C)(C)C)c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ HDAC3 O15379 4/20 0.48
▸ HDAC4 P56524 4/20 0.48
▸ HDAC1 Q13547 4/20 0.48
▸ HDAC7 Q8WUI4 4/20 0.48
▸ HDAC2 Q92769 4/20 0.48
▸ HDAC10 Q969S8 4/20 0.48
▸ HDAC11 Q96DB2 4/20 0.48
▸ HDAC8 Q9BY41 4/20 0.48
▸ HDAC6 Q9UBN7 4/20 0.48
▸ HDAC9 Q9UKV0 4/20 0.48
▸ HDAC5 Q9UQL6 4/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ TACR1 P25103 2/20 0.47
▸ SCN9A Q15858 2/20 0.46

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
SCHEMBL21466567 1.00 MAPT (0.55) MAPTSMN1; SMN2MEN1LMNAKMT2A
SCHEMBL24701941 1.00 MAPT (0.55) MAPTSMN1; SMN2MEN1LMNAKMT2A
SCHEMBL25910675 0.90 MAPT (0.54) MAPTSMN1; SMN2MEN1LMNAKMT2A
SCHEMBL25910632 0.90 MAPT (0.54) MAPTSMN1; SMN2MEN1LMNAKMT2A
SCHEMBL21466530 0.88 CTSL (0.55) MAPTSMN1; SMN2KMT2AHDAC3HDAC4
SCHEMBL21466552 0.88 CTSL (0.55) MAPTSMN1; SMN2KMT2AHDAC3HDAC4
SCHEMBL24702172 0.88 CTSL (0.55) MAPTSMN1; SMN2KMT2AHDAC3HDAC4
SCHEMBL24787792 0.86 HDAC3 (0.46) MAPTSMN1; SMN2MEN1LMNAKMT2A
SCHEMBL23127326 0.84 ACE (0.54) MAPTMEN1KMT2AHDAC3HDAC4
SCHEMBL28551115 0.84 ACE (0.54) MAPTMEN1KMT2AHDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4101855-B1 ANTITUMORAL COMPOUNDS PHARMA MAR SA (ES) 2023-08-02 — — EP disclosed
US-11713325-B2 Antitumoral compounds PHARMA MAR, S.A. (ES) 2023-08-01 — — US disclosed
US-20230012681-A1 ANTIBODY DRUG CONJUGATES COMPRISING ECTEINASCIDIN DERIVATIVES PHARMA MAR, S.A. (ES) 2023-01-19 — — US disclosed
EP-3870234-B1 ANTIBODY DRUG CONJUGATES COMPRISING ECTEINASCIDIN DERIVATIVES PHARMA MAR SA (ES) 2022-12-21 — — EP disclosed
EP-4101855-A1 ANTITUMORAL COMPOUNDS Pharma Mar S.A. (ES) 2022-12-14 — — EP disclosed
US-20220242883-A1 Antitumoral Compounds PHARMA MAR SA (ES) 2022-08-04 — — US disclosed
US-11339180-B2 Antitumoral compounds PHARMA MAR, S.A. (ES) 2022-05-24 — — US disclosed
US-11332480-B2 Antitumoral compounds PHARMA MAR, S.A. (ES) 2022-05-17 — — US disclosed
US-20210246146-A1 ANTITUMORAL COMPOUNDS PHARMA MAR SA (ES) 2021-08-12 — — US disclosed
US-20210070775-A1 Antitumoral Compounds PHARMA MAR, S.A. (ES) 2021-03-11 — — US disclosed
US-10538535-B2 Antitumoral compounds PHARMA MAR, S.A. (ES) 2020-01-21 — — US disclosed
US-10442820-B2 — — 2019-10-15 — — 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 (9 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-10538535-B2 Antitumoral compounds TP53, RB1, XPOT MAPT 4761/4885SMN1; SMN2 2945/4885MEN1 553/4885
US-11332480-B2 Antitumoral compounds TP53, RB1, XPOT MAPT 4761/4885SMN1; SMN2 2945/4885MEN1 553/4885
US-20210070775-A1 Antitumoral Compounds TP53, RB1, XPOT MAPT 4761/4885SMN1; SMN2 2945/4885MEN1 553/4885
US-10442820-B2 — RPS4X, RPS4Y1, XPOT MAPT 4701/4885SMN1; SMN2 2686/4885MEN1 518/4885
US-20230012681-A1 ANTIBODY DRUG CONJUGATES COMPRISING ECTEINASCIDIN DERIVATIVES HDGF, XPOT, TXLNA MAPT 34/4885SMN1; SMN2 3582/4885MEN1 2468/4885
US-11713325-B2 Antitumoral compounds TP53, TOP1, MCL1 MAPT 4519/4885SMN1; SMN2 2847/4885MEN1 246/4885
US-11339180-B2 Antitumoral compounds TP53, TOP1, MCL1 MAPT 4519/4885SMN1; SMN2 2847/4885MEN1 246/4885
US-20210246146-A1 ANTITUMORAL COMPOUNDS TP53, TOP1, MCL1 MAPT 4519/4885SMN1; SMN2 2847/4885MEN1 246/4885
US-20220242883-A1 Antitumoral Compounds TP53, TOP1, MCL1 MAPT 4519/4885SMN1; SMN2 2847/4885MEN1 246/4885

“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.

Send feedback