SCHEMBL20722902

SCHEMBL20722902

O=C(O)N[C@H]1COc2nc(Cl)ccc2C1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.40
MTNR1A P48039 2/20 0.37
POLB P06746 2/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.36
MAPT P10636 2/20 0.34
MALT1 Q9UDY8 4/20 0.34

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
SCHEMBL20722904 1.00 P2RX7 (0.40) P2RX7MTNR1APOLBLMNATP53
SCHEMBL17644425 0.84 MTNR1A (0.41) P2RX7MTNR1APOLBLMNATP53
SCHEMBL28566229 0.83 ALDH1A1 (0.50) P2RX7
SCHEMBL30968461 0.83 ALDH1A1 (0.50) P2RX7
SCHEMBL28566232 0.83 ALDH1A1 (0.50) P2RX7
SCHEMBL20722869 0.73 POLB (0.56) MTNR1APOLBLMNATP53MAPT
SCHEMBL20723033 0.71 MTNR1A (0.45) P2RX7MTNR1APOLBLMNATP53
SCHEMBL28573640 0.71 P2RX7 (0.33) P2RX7
SCHEMBL20723030 0.71 MTNR1A (0.45) P2RX7MTNR1APOLBLMNATP53
SCHEMBL28573643 0.71 P2RX7 (0.33) P2RX7

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
US-11524966-B1 Carboxamides as ubiquitin-specific protease inhibitors VALO HEALTH, INC. (US) 2022-12-13 US disclosed
US-20210323975-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS VALO EARLY DISCOVERY, INC. 2021-10-21 US disclosed
EP-3833661-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS Valo Early Discovery, Inc. (US) 2021-06-16 EP disclosed
EP-3665169-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS Forma Therapeutics, Inc. (US) 2020-06-17 EP disclosed
WO-2020033707-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS FORMA THERAPEUTICS, INC. (US) 2020-02-13 WO disclosed
WO-2019032863-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS FORMA THERAPEUTICS, INC. (US) 2019-02-14 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 (2 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-11524966-B1 Carboxamides as ubiquitin-specific protease inhibitors USP28, USP25, USP24 P2RX7 3760/4885MTNR1A 2969/4885POLB 3179/4885
US-20210323975-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS USP28, USP25, USP24 P2RX7 3760/4885MTNR1A 2969/4885POLB 3179/4885

“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.