SCHEMBL9907371

SCHEMBL9907371

O=C(O)c1ccc2nccc(-c3cccc(Cl)c3F)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.53
DOT1L Q8TEK3 1/20 0.43
CSNK2A1 P68400 2/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
RORC P51449 3/20 0.39
GPBAR1 Q8TDU6 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPKAPK2 P49137 1/20 0.39
TTR P02766 2/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
CSNK2A2 P19784 3/20 0.39
CSNK2B P67870 3/20 0.39
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM5A P29375 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
SCHEMBL9907343 0.87 DOT1L (0.42) KMODOT1LCSNK2A1MRGPRX4MAPKAPK2
SCHEMBL9907368 0.86 ALOX15 (0.50) KMODOT1LCSNK2A1GPBAR1RAB9A
SCHEMBL9907394 0.85 CSNK2A2 (0.43) MRGPRX4RAB9ANPC1CSNK2A2CSNK2B
SCHEMBL9907470 0.85 CSNK2A2 (0.41) KMOCSNK2A1RORCGPBAR1CYP2C9
SCHEMBL9907363 0.84 DOT1L (0.44) KMODOT1LCSNK2A1MAPKAPK2TTR
SCHEMBL9907344 0.84 HTR5A (0.43) KMODOT1LCSNK2A1RORCCYP2C9
SCHEMBL9907803 0.84 HTR5A (0.54) KMO
SCHEMBL9909198 0.83 KMO (0.43) KMOMRGPRX4RORCCYP2C9TTR
SCHEMBL7919877 0.81 PLA2G2D (0.50) KMOCSNK2A1MRGPRX4RORCTTR
SCHEMBL9907478 0.81 HTR5A (0.41) KMOCYP2C9MAPKAPK2ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
EP-2463276-B1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2014-03-12 EP disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US 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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E KMO 559/4885DOT1L 785/4885CSNK2A1 4309/4885

“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.