SCHEMBL17165584

SCHEMBL17165584

Cc1sc(NC(=O)[C@@H](N)CO)c(C(=O)c2ccc(Cl)cc2)c1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.57
▸ MAPT P10636 7/20 0.57
▸ LMNA P02545 4/20 0.57
▸ HPGD P15428 6/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ PLA2G1B P04054 1/20 0.52
▸ ATG4B Q9Y4P1 1/20 0.52
▸ NPSR1 Q6W5P4 3/20 0.51
▸ HTT P42858 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ CNR2 P34972 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ CYP2C19 P33261 2/20 0.44

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
SCHEMBL17165585 1.00 ALDH1A1 (0.57) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL31498681 0.90 ALDH1A1 (0.57) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL23728786 0.88 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL19136021 0.88 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL15281425 0.88 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL31498738 0.87 ALDH1A1 (0.54) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL30411459 0.86 ALDH1A1 (0.53) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL30012531 0.86 ALDH1A1 (0.60) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL18418518 0.84 ALDH1A1 (0.51) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL18418519 0.84 ALDH1A1 (0.51) ALDH1A1MAPTLMNAHPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3129378-B1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER KAINOS MEDICINE INC (KR) 2019-06-26 — — EP disclosed
EP-3129378-B1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER KAINOS MEDICINE INC (KR) 2019-06-26 — — EP disclosed
US-9884874-B2 Bromodomain-inhibiting compounds and pharmaceutical composition comprising same for preventing or treating a cancer KAINOS MEDICINE, INC. (KR) 2018-02-06 — — US disclosed
US-9884874-B2 Bromodomain-inhibiting compounds and pharmaceutical composition comprising same for preventing or treating a cancer KAINOS MEDICINE, INC. (KR) 2018-02-06 — — US disclosed
US-9884874-B2 Bromodomain-inhibiting compounds and pharmaceutical composition comprising same for preventing or treating a cancer KAINOS MEDICINE, INC. (KR) 2018-02-06 — — US disclosed
US-20170174702-A1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER KAINOS MEDICINE, INC. (KR) 2017-06-22 — — US disclosed
US-20170174702-A1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER KAINOS MEDICINE, INC. (KR) 2017-06-22 — — US disclosed
US-20170174702-A1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER KAINOS MEDICINE, INC. (KR) 2017-06-22 — — US disclosed
EP-3129378-A1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER Kainos Medicine, Inc. (KR) 2017-02-15 — — EP disclosed
WO-2015156601-A1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER KAINOS MEDICINE, INC. (KR) 2015-10-15 — — WO disclosed
WO-2015156601-A1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER KAINOS MEDICINE, INC. (KR) 2015-10-15 — — 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 (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-20170174702-A1 BROMODOMAIN-INHIBITING COMPOUNDS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME FOR PREVENTING OR TREATING A CANCER BRDT, BRD4, BAZ2A ALDH1A1 4118/4885MAPT 2395/4885LMNA 877/4885

“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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