SCHEMBL21525527

SCHEMBL21525527

O=C(O)c1nnc(C2CC2)o1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADCY1 Q08828 6/20 0.39
EPHX2 P34913 4/20 0.39
PTPN1 P18031 1/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
CYP2C19 P33261 1/20 0.34
ADCY8 P40145 1/20 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
SCHEMBL24724145 0.82 KMT2A (0.46) ADCY1EPHX2MAPTMEN1KMT2A
SCHEMBL6431313 0.82 CA1 (0.38) ADCY1EPHX2MAPTMEN1KMT2A
SCHEMBL16278092 0.78 HTR4 (0.47)
SCHEMBL408394 0.75 NPC1 (0.42) ADCY1EPHX2MAPTMEN1KMT2A
SCHEMBL439761 0.75 NPC1 (0.42) ADCY1EPHX2MAPTMEN1KMT2A
SCHEMBL17040253 0.74 PTPN1 (0.50) PTPN1
SCHEMBL20305423 0.73 CA1 (0.43) ADCY1MAPTMEN1KMT2ACA1
SCHEMBL442998 0.73 PKM (0.41) ADCY1EPHX2PTPN1MEN1KMT2A
SCHEMBL408407 0.73 PKM (0.41) ADCY1EPHX2PTPN1MEN1KMT2A
Hydrochloric Acid SCHEMBL11596232 0.71 PTPN1 (0.48) PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3623372-B1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH INC (US) 2026-02-04 EP disclosed
EP-3623372-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Forma Therapeutics, Inc. (US) 2020-03-18 EP disclosed
EP-3240791-B1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS FORMA THERAPEUTICS INC (US) 2019-11-06 EP disclosed