SCHEMBL17186380

SCHEMBL17186380

Nc1nc2[nH]cnc2c(=O)n1CCN1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 5/20 0.39
▸ HSD17B10 Q99714 4/20 0.39
▸ ALDH1A1 P00352 7/20 0.39
▸ TSHR P16473 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ KDM4E B2RXH2 6/20 0.36
▸ HPGD P15428 4/20 0.36
▸ TLR9 Q9NR96 2/20 0.36
▸ TLR7 Q9NYK1 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ GLA P06280 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CASP1 P29466 2/20 0.35
▸ CASP7 P55210 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35

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 SCHEMBL18605997 0.99 GAA (0.39) GAAHSD17B10ALDH1A1TSHRSMN1; SMN2
SCHEMBL17186375 0.90 KDM5B (0.39) GAAHSD17B10ALDH1A1SMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL18605582 0.89 KDM5B (0.38) GAAHSD17B10ALDH1A1SMN1; SMN2KMT2A
SCHEMBL17186383 0.80 TLR9 (0.41) GAAALDH1A1TSHRSMN1; SMN2TLR9
Hydrochloric Acid SCHEMBL18605998 0.79 TLR9 (0.40) GAAALDH1A1TSHRSMN1; SMN2TLR9
SCHEMBL3671337 0.79 PNP (0.37) TSHRMAPTLMNA
SCHEMBL667794 0.79 PDE4A (0.49) HSD17B10HPGD
SCHEMBL9960806 0.78 PNP (0.38) MAPTLMNA
SCHEMBL17186419 0.77 PIK3CA (0.35) HPGDTLR7MAPTLMNA
SCHEMBL8196740 0.76 ADORA2B (0.37) SMN1; SMN2MEN1KMT2AHPGDMAPT

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 GAA 604/4885HSD17B10 1504/4885ALDH1A1 1471/4885

“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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