SCHEMBL22929174

SCHEMBL22929174

O=C1CC(c2ccccc2)N1P

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.45
PKM P14618 1/20 0.45
BRD4 O60885 3/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
RAB9A P51151 1/20 0.43
ATM Q13315 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA7 P36544 1/20 0.41
CHRNA4 P43681 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL4132243 0.75 RIPK1 (0.49) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL11133372 0.75 RIPK1 (0.45) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL11133370 0.75 RIPK1 (0.45) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL12620555 0.75 RIPK1 (0.56) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL523273 0.73 ESR1 (0.62) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL24775446 0.71 RIPK1 (0.55) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL1827356 0.71 RIPK1 (0.45) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL30054156 0.71 RIPK1 (0.53) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL17870940 0.71 RIPK1 (0.53) RIPK1BRD4KMT2AALDH1A1TSHR
SCHEMBL17870941 0.71 RIPK1 (0.53) RIPK1BRD4KMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10906913-B2 NMDA receptor modulators and uses thereof NORTHWESTERN UNIVERSITY (US) 2021-02-02 US 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-10906913-B2 NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A RIPK1 1059/4885PKM 1023/4885BRD4 2815/4885

“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.