SCHEMBL31355233

SCHEMBL31355233

Cc1ncccc1C1CC1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
P2RX7 Q99572 3/20 0.41
SLC9A1 P19634 3/20 0.38
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
GPR119 Q8TDV5 1/20 0.34
SSTR4 P31391 2/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
SSTR1 P30872 1/20 0.33
FAAH O00519 1/20 0.33
NAMPT P43490 1/20 0.33
AHR P35869 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL31076279 0.86 FFAR4 (0.41) MKNK1MKNK2P2RX7CYP2C9
SCHEMBL30715019 0.83 NAPRT (0.42) MKNK1MKNK2P2RX7SLC9A1NPC1
SCHEMBL30715028 0.81 SLC9A1 (0.44) P2RX7SLC9A1NPC1MAPTRAB9A
SCHEMBL31355231 0.75 MAP4K1 (0.33) SLC9A1IRAK4FAAHALDH1A1CYP1A2
SCHEMBL31355234 0.74 OPRM1 (0.41) P2RX7SLC9A1NPC1MAPTRAB9A
SCHEMBL30243669 0.72 GPR88 (0.45) NPC1MAPTRAB9AALDH1A1
SCHEMBL21439582 0.71 SLC9A1 (0.43) SLC9A1SMN1; SMN2ALDH1A1
SCHEMBL4138471 0.70 KDM1A (0.55) SLC9A1ALDH1A1
SCHEMBL15541759 0.70 KDM1A (0.56) SLC9A1MAPTALDH1A1
SCHEMBL15541112 0.70 KDM1A (0.56) SLC9A1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026041636-A1 MACROCYCLE COMPOUNDS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2026-02-26 WO claimed
US-12247036-B2 Tricyclic compounds for the treatment of cancer HOFFMANN-LA ROCHE INC. (US) 2025-03-11 US claimed
US-20240417410-A1 TRICYCLIC COMPOUNDS FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2024-12-19 US claimed
WO-2026041636-A1 MACROCYCLE COMPOUNDS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2026-02-26 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-20240417410-A1 TRICYCLIC COMPOUNDS FOR THE TREATMENT OF CANCER H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNI, TOP2B MKNK1 2331/4885MKNK2 2295/4885P2RX7 4090/4885
US-12247036-B2 Tricyclic compounds for the treatment of cancer H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNI, TOP2B MKNK1 2331/4885MKNK2 2295/4885P2RX7 4090/4885

“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.