SCHEMBL13198112

SCHEMBL13198112

Cc1ccc(NC(=O)NC2CCCCC2)cc1-c1ccc2ccncc2c1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.64
LCK P06239 2/20 0.64
CSF1R P07333 2/20 0.64
KDR P35968 2/20 0.64
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
PRMT3 O60678 3/20 0.55
TSHR P16473 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
EPHX2 P34913 1/20 0.54
EGFR P00533 1/20 0.52
ERBB4 Q15303 1/20 0.52
AAK1 Q2M2I8 1/20 0.52
EPHX1 P07099 2/20 0.51
ABL1 P00519 5/20 0.51
POLB P06746 1/20 0.50

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
SCHEMBL13198107 1.00 MAPK14 (0.64) MAPK14LCKCSF1RKDRNPC1
SCHEMBL13198114 0.99 MAPK14 (0.65) MAPK14LCKCSF1RKDRNPC1
SCHEMBL4962163 0.86 PRMT3 (0.70) NPC1RAB9APRMT3SMN1; SMN2EPHX2
SCHEMBL4962243 0.86 PRMT3 (0.70) NPC1RAB9APRMT3SMN1; SMN2EPHX2
SCHEMBL29450608 0.83 POLB (0.60) KDRNPC1RAB9APRMT3TSHR
SCHEMBL2893609 0.81 IMPDH2 (0.64) MAPK14LCKCSF1RKDRNPC1
SCHEMBL13198113 0.81 POLB (0.56) MAPK14LCKCSF1RKDRNPC1
SCHEMBL29450622 0.81 KMT2A (0.54) MAPK14LCKCSF1RKDRNPC1
SCHEMBL13198118 0.80 MEN1 (0.59) MAPK14LCKCSF1RKDRNPC1
SCHEMBL13198091 0.80 MAPK14 (0.53) MAPK14LCKCSF1RKDREGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER MSD K.K. (JP) 2010-08-05 US disclosed
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER MSD K.K. (JP) 2010-08-05 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-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER EPHA4, EPHA1, ERBB4 MAPK14 146/4885LCK 140/4885CSF1R 1059/4885

“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.