SCHEMBL8145515

SCHEMBL8145515

Nc1nc2[nH]cnc2c(=O)n1Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.48
▸ HSP90B1 P14625 3/20 0.46
▸ TRAP1 Q12931 3/20 0.46
▸ TYMS P04818 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ PNP P00491 2/20 0.42
▸ KCNH2 Q12809 1/20 0.41
▸ SRC P12931 1/20 0.39
▸ PRKACA P17612 1/20 0.39
▸ PRKACG P22612 1/20 0.39
▸ PRKACB P22694 1/20 0.39
▸ CCR2 P41597 3/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ TLR7 Q9NYK1 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
Hydrochloric Acid SCHEMBL17186450 0.99 KMT2A (0.47) KMT2AHSP90B1TRAP1TYMSCYP1A2
SCHEMBL17186218 0.88 KMT2A (0.41) KMT2AHSP90B1TRAP1TYMSCYP1A2
SCHEMBL3308556 0.88 PNP (0.45) TYMSSMN1; SMN2PNPTLR7
Hydrochloric Acid SCHEMBL18605838 0.87 KMT2A (0.40) KMT2AHSP90B1TRAP1TYMSCYP1A2
SCHEMBL1262618 0.85 PNP (0.45) KMT2APNP
SCHEMBL3310264 0.84 PNP (0.44) KMT2ATYMSCYP1A2CYP2C9CYP2C19
SCHEMBL1533545 0.84 MPO (0.48) KMT2ATYMSCYP1A2CYP3A4CYP2C9
SCHEMBL3021036 0.84 PNP (0.44) KMT2APNPTLR7
SCHEMBL3303803 0.84 PNP (0.44) KMT2APNPTLR7
SCHEMBL18247 0.84 PNP (0.59) KMT2APNP

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 6 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-0772439-B1 Novel antibiotic compounds and antibiotic compositions comprising said compounds for inhibiting gram positive bacteria and mycoplasma cells. UNIV MASSACHUSETTS MEDICAL (US) 2000-10-04 — — EP 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 KMT2A 1792/4885HSP90B1 924/4885TRAP1 160/4885

“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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