SCHEMBL20943263

SCHEMBL20943263

CC(=O)OCCc1ccc(Cl)nc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
KMT2A Q03164 4/20 0.47
MEN1 O00255 2/20 0.47
ATM Q13315 1/20 0.47
RAB9A P51151 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
NPC1 O15118 2/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.42
FFAR1 O14842 1/20 0.41
DGAT1 O75907 1/20 0.41
POLB P06746 2/20 0.40
PKM P14618 1/20 0.40
NAPRT Q6XQN6 1/20 0.40

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
SCHEMBL2134732 0.83 ALDH1A1 (0.57) ALDH1A1KMT2AMEN1ATMRAB9A
SCHEMBL27718312 0.82 TSHR (0.51) ALDH1A1KMT2AMEN1L3MBTL1MAPT
SCHEMBL20719611 0.81 RAD52 (0.38) ALDH1A1KMT2AMEN1L3MBTL1MAPT
SCHEMBL30554484 0.81 RAD52 (0.38) ALDH1A1KMT2AMEN1L3MBTL1MAPT
SCHEMBL20943257 0.78 AOC3 (0.41) ALDH1A1KMT2AMEN1L3MBTL1MAPT
SCHEMBL5717114 0.78 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1ATMRAB9A
SCHEMBL31508111 0.78 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1RAB9AL3MBTL1
SCHEMBL1067152 0.78 SIRT2 (0.47) ALDH1A1KMT2AMEN1L3MBTL1MAPT
Hydrochloric Acid SCHEMBL20719485 0.77 AOC3 (0.40) ALDH1A1KMT2AMEN1L3MBTL1MAPT
SCHEMBL20719579 0.77 ACACB (0.43) ALDH1A1MAPTFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3476829-B1 BIARYL UREA DERIVATIVE OR SALT THEREOF, AND MANUFACTURING AND APPLICATION OF SAME UNIV FUDAN (CN) 2021-12-15 EP disclosed
US-10851050-B2 Biaryl urea derivative or salt thereof and preparation process and use for the same FUDAN UNIVERSITY (CN) 2020-12-01 US disclosed
US-20200239411-A1 BIARYL UREA DERIVATIVE OR SALT THEREOF AND PREPARATION PROCESS AND USE FOR THE SAME UNIV FUDAN (CN) 2020-07-30 US disclosed
US-10647665-B2 Biaryl urea derivative or salt thereof and preparation process and use for the same FUDAN UNIVERSITY (CN) 2020-05-12 US disclosed
US-20190248737-A1 BIARYL UREA DERIVATIVE OR SALT THEREOF AND PREPARATION PROCESS AND USE FOR THE SAME FUDAN UNIVERSITY (CN) 2019-08-15 US disclosed
EP-3476829-A1 BIARYL UREA DERIVATIVE OR SALT THEREOF, AND MANUFACTURING AND APPLICATION OF SAME Fudan University (CN) 2019-05-01 EP 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 (4 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-20200239411-A1 BIARYL UREA DERIVATIVE OR SALT THEREOF AND PREPARATION PROCESS AND USE FOR THE SAME RORC, RORB, RORA ALDH1A1 644/4885KMT2A 1108/4885MEN1 4267/4885
US-20190248737-A1 BIARYL UREA DERIVATIVE OR SALT THEREOF AND PREPARATION PROCESS AND USE FOR THE SAME RORC, RORB, RORA ALDH1A1 655/4885KMT2A 1157/4885MEN1 4328/4885
US-10647665-B2 Biaryl urea derivative or salt thereof and preparation process and use for the same RORC, RORB, RORA ALDH1A1 655/4885KMT2A 1157/4885MEN1 4328/4885
US-10851050-B2 Biaryl urea derivative or salt thereof and preparation process and use for the same RORC, RORB, RORA ALDH1A1 644/4885KMT2A 1108/4885MEN1 4267/4885

“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.