SCHEMBL21733488

SCHEMBL21733488

CCOC(=O)C1CC(C)C(c2c(C)c(C)cc(N(Cc3ccc(OC)cc3)Cc3ccc(OC)cc3)c2F)CC1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.33
ALDH1A1 P00352 8/20 0.33
TSHR P16473 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MAPK1 P28482 2/20 0.33
TSPO P30536 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 2/20 0.31
KDM4E B2RXH2 2/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 2/20 0.31
HSD17B10 Q99714 2/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
RXFP1 Q9HBX9 1/20 0.30
MAOA P21397 1/20 0.30

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
SCHEMBL21733767 0.92 TP53 (0.32) TP53ALDH1A1TSHRSMN1; SMN2MAPK1
SCHEMBL26268266 0.90 TP53 (0.32) TP53ALDH1A1TSHRTSPOUSP2
SCHEMBL21733838 0.90 TP53 (0.32) TP53ALDH1A1TSHRTSPOUSP2
SCHEMBL26268592 0.85 ALDH1A1 (0.34) TP53ALDH1A1TSHRMAPK1LMNA
SCHEMBL21733627 0.83 TP53 (0.33) TP53ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL26269144 0.82 TP53 (0.31) TP53ALDH1A1TSHRTSPOUSP2
SCHEMBL28493072 0.81 TSPO (0.32) ALDH1A1TSHRSMN1; SMN2MAPK1TSPO
SCHEMBL24855041 0.80 KDM4E (0.34) ALDH1A1KDM4EGAAMAPTHSD17B10
SCHEMBL21733487 0.79 NR3C1 (0.34) ALDH1A1TSHRSMN1; SMN2MAPK1TSPO
SCHEMBL21733858 0.76 PDE10A (0.33) TP53ALDH1A1TSHRSMN1; SMN2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11760744-B2 Fused ring compounds GENENTECH, INC. (US) 2023-09-19 US disclosed
WO-2020035031-A1 FUSED RING COMPOUNDS GENENTECH, INC. (US) 2020-02-20 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 (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-11760744-B2 Fused ring compounds KRAS, NRAS, HRAS TP53 23/4885ALDH1A1 3678/4885TSHR 3363/4885

“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.