SCHEMBL6494874

SCHEMBL6494874

CCc1cc2nc(C(C)CCC(=O)NC)cc(-c3ccc(Cl)cc3Cl)n2n1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
SHMT1 P34896 2/20 0.35
SHMT2 P34897 2/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.34
NLRP1 Q9C000 1/20 0.34
MARS1 P56192 1/20 0.34
CNR1 P21554 3/20 0.33
DPP4 P27487 2/20 0.33
DPP8 Q6V1X1 2/20 0.33
ALPL P05186 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
DPP9 Q86TI2 1/20 0.33
CRHR1 P34998 1/20 0.33

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
SCHEMBL6498648 0.90 SHMT1 (0.38) SHMT1SHMT2NPC1MARS1CNR1
SCHEMBL6494882 0.73 NPC1 (0.42) NPC1ALPL
SCHEMBL6070738 0.66 CRHR1 (0.45) NPC1HPGDDPP4DPP8CRHR1
SCHEMBL1943591 0.63 EGLN2 (0.49) NPC1HPGDMARS1CRHR1
SCHEMBL6500995 0.60 CRHR1 (0.41) CRHR1
SCHEMBL14014232 0.59 KDM4E (0.53) NPC1MARS1ALPL
SCHEMBL12680498 0.58 L3MBTL1 (0.50) L3MBTL1CNR1DPP4DPP8ALPL
SCHEMBL6505240 0.58 NPC1 (0.46) NPC1
SCHEMBL12680466 0.57 L3MBTL1 (0.49) L3MBTL1CNR1DPP4DPP8ALPL
SCHEMBL24425230 0.57 MAPT (0.44) MARS1CNR1ALPL

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
US-6958341-B2 Pyrazolopyrimidines as CRF antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-10-25 US claimed
US-6958341-B2 Pyrazolopyrimidines as CRF antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-10-25 US disclosed
US-20030139426-A1 Pyrazolopyrimidines as CRF antagonists WILDE RICHARD G (US) 2003-07-24 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-20030139426-A1 Pyrazolopyrimidines as CRF antagonists CRHR1, CRHR2, CRH L3MBTL1 3853/4885SHMT1 3970/4885SHMT2 4056/4885

“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.