SCHEMBL1583944

SCHEMBL1583944

CCOC(=O)c1nc2c(C(F)(F)F)cc(Cl)cn2c1Cl

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 4/20 0.41
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.38
GABRA2 P47869 3/20 0.38
GABRB2 P47870 3/20 0.38
PKM P14618 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPT P10636 1/20 0.37
GLP1R P43220 1/20 0.37
TARBP2 Q15633 1/20 0.37

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
SCHEMBL3058871 0.88 POLB (0.39) RXFP1L3MBTL1KDM4ENPC1RAB9A
SCHEMBL19187939 0.85 NPSR1 (0.37) RXFP1KMT2AL3MBTL1KDM4ENPC1
SCHEMBL3063932 0.81 ALDH1A1 (0.37) RXFP1L3MBTL1KDM4EALDH1A1GABRA2
SCHEMBL1583259 0.81 KMT2A (0.42) RXFP1KMT2AKDM4EPKMMAPT
SCHEMBL3690164 0.81 ALDH1A1 (0.47) KMT2AL3MBTL1KDM4EALDH1A1PKM
SCHEMBL1583734 0.79 MAPT (0.37) RXFP1KMT2AKDM4ENPC1RAB9A
SCHEMBL1583217 0.77 KDM4E (0.46) L3MBTL1KDM4EALDH1A1GABRA2GABRB2
SCHEMBL13090307 0.76 POLB (0.40) RXFP1L3MBTL1KDM4EALDH1A1CYP1A2
SCHEMBL1583803 0.76 NOTUM (0.36) RXFP1KMT2AKDM4ERAB9AALDH1A1
SCHEMBL1583417 0.76 RXFP1 (0.36) RXFP1KMT2AKDM4EPKMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011041713-A2 PIPERAZINYL ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2011-04-07 WO disclosed
US-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents BASKARAN SUBRAMANIAN 2010-10-28 US disclosed
WO-2010091411-A1 PIPERIDINYL CYCLIC AMIDO ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2010-08-12 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-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents ZC3HAV1, MAVS, EIF2AK2 RXFP1 4014/4885KMT2A 4584/4885L3MBTL1 4680/4885

“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.