SCHEMBL21861986

SCHEMBL21861986

COC(=O)C(=N)c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
HPGD P15428 2/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ERCC5 P28715 1/20 0.46
FEN1 P39748 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
POLB P06746 1/20 0.46
GFER P55789 1/20 0.46
CYP2C19 P33261 2/20 0.45
SLC6A2 P23975 2/20 0.45
PKM P14618 1/20 0.45
GRM5 P41594 1/20 0.45
CHRNA1 P02708 1/20 0.45
CHRNG P07510 1/20 0.45
ITGA5 P08648 1/20 0.45
CHRNB1 P11230 1/20 0.45
CHRNB2 P17787 1/20 0.45

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
SCHEMBL27745236 0.83 PARP1 (0.50) PARP1NPC1RAB9AHPGDMEN1
SCHEMBL2878179 0.82 PARP1 (0.53) PARP1NPC1RAB9AHPGDMEN1
SCHEMBL16891395 0.80 PARP1 (0.59) PARP1NPC1RAB9AHPGDMEN1
SCHEMBL19675427 0.79 CES2 (0.53) PARP1NPC1RAB9AMEN1KMT2A
SCHEMBL6556491 0.79 PARP1 (0.50) PARP1NPC1RAB9AHPGDMEN1
SCHEMBL19309855 0.78 ALDH1A1 (0.49) NPC1RAB9AHPGDMEN1KMT2A
SCHEMBL13232314 0.78 PARP1 (0.47) PARP1NPC1RAB9AHPGDMEN1
SCHEMBL29406761 0.78 RAB9A (0.59) PARP1NPC1RAB9AHPGDMEN1
SCHEMBL642345 0.78 RAB9A (0.59) PARP1NPC1RAB9AHPGDMEN1
SCHEMBL27672035 0.78 PARP1 (0.49) PARP1NPC1RAB9AHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230065368-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. 2023-03-02 US disclosed
US-20210346356-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. 2021-11-11 US disclosed
WO-2021055668-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. (US) 2021-03-25 WO disclosed
WO-2020191022-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. (US) 2020-09-24 WO disclosed
WO-2020061252-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. (US) 2020-03-26 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-20210346356-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X USP9X, RBX1, USP19 PARP1 561/4885NPC1 3400/4885RAB9A 593/4885
US-20230065368-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X USP9X, USP19, USP39 PARP1 1678/4885NPC1 2728/4885RAB9A 210/4885

“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.