SCHEMBL17186591

SCHEMBL17186591

Cc1cc(F)ccc1Cn1c(N)nc2[nH]cnc2c1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 6/20 0.39
▸ GRIN1 Q05586 7/20 0.36
▸ GRIN2B Q13224 7/20 0.36
▸ TRPC5 Q9UL62 1/20 0.36
▸ ROCK2 O75116 1/20 0.35
▸ KDM4C Q9H3R0 1/20 0.34
▸ NR3C2 P08235 1/20 0.34
▸ JAK3 P52333 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
Hydrochloric Acid SCHEMBL17186319 0.99 P2RX7 (0.38) P2RX7GRIN1GRIN2BTRPC5ROCK2
SCHEMBL17186608 0.89 NR3C2 (0.37) P2RX7GRIN1GRIN2BKDM4CNR3C2
SCHEMBL17186335 0.89 HSP90B1 (0.35) ROCK2
Hydrochloric Acid SCHEMBL17186602 0.88 NR3C2 (0.36) P2RX7GRIN1GRIN2BKDM4CNR3C2
Hydrochloric Acid SCHEMBL17186217 0.88 HSP90B1 (0.35) ROCK2
SCHEMBL17186377 0.84 TRAP1 (0.47) KDM4C
SCHEMBL6952177 0.84 MEN1 (0.41) —
Hydrochloric Acid SCHEMBL17186448 0.83 TRAP1 (0.47) KDM4C
Hydrochloric Acid SCHEMBL18606028 0.83 MEN1 (0.40) —
SCHEMBL18605738 0.82 HSP90AB1 (0.42) P2RX7TRPC5ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2017-03-16 — — US claimed
EP-3131877-A1 GUANIDINE COMPOUNDS AND USE THEREOF Immunomet Therapeutics Inc. (US) 2017-02-22 — — EP claimed
WO-2015160220-A1 GUANIDINE COMPOUNDS AND USE THEREOF HANALL BIOPHARMA CO., LTD. (KR) 2015-10-22 — — WO claimed
EP-3131877-B1 BIGUANIDE COMPOUNDS IMMUNOMET THERAPEUTICS INC (US) 2023-07-19 — — EP disclosed
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2017-03-16 — — US disclosed
EP-3131877-A1 GUANIDINE COMPOUNDS AND USE THEREOF Immunomet Therapeutics Inc. (US) 2017-02-22 — — EP disclosed
WO-2015160220-A1 GUANIDINE COMPOUNDS AND USE THEREOF HANALL BIOPHARMA CO., LTD. (KR) 2015-10-22 — — 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-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF PC, TFAM, PCK2 P2RX7 2421/4885GRIN1 1341/4885GRIN2B 2209/4885

“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.

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