SCHEMBL4901353

SCHEMBL4901353

Cc1nc2ccncc2n1[C@H]1C[C@H]2CC[C@@H](C1)N2/C(S)=N/c1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.38
CYP11B1 P15538 1/20 0.38
KCNH2 Q12809 3/20 0.36
AOC3 Q16853 8/20 0.35
IDO1 P14902 1/20 0.33
CCR5 P51681 6/20 0.33
CYP2D6 P10635 1/20 0.32
CCNT1 O60563 1/20 0.32
CDK9 P50750 1/20 0.32
MCHR1 Q99705 1/20 0.32

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
SCHEMBL4901357 1.00 CYP11B2 (0.38) CYP11B2CYP11B1KCNH2AOC3IDO1
SCHEMBL8258510 0.87 CCR5 (0.38) CYP11B2CYP11B1KCNH2AOC3IDO1
SCHEMBL4902105 0.80 CYP11B2 (0.40) CYP11B2CYP11B1KCNH2AOC3IDO1
SCHEMBL4902112 0.80 CYP11B2 (0.40) CYP11B2CYP11B1KCNH2AOC3IDO1
SCHEMBL6167224 0.77 CCR5 (0.42) CYP11B2KCNH2AOC3CCR5CYP2D6
SCHEMBL4011538 0.77 CCR5 (0.42) CYP11B2KCNH2AOC3CCR5CYP2D6
SCHEMBL6167230 0.77 CCR5 (0.42) CYP11B2KCNH2AOC3CCR5CYP2D6
SCHEMBL4011542 0.77 CCR5 (0.42) CYP11B2KCNH2AOC3CCR5CYP2D6
SCHEMBL8255904 0.76 CYP11B2 (0.36) CYP11B2CYP11B1KCNH2AOC3IDO1
SCHEMBL4711526 0.72 AOC3 (0.44) CYP11B2CYP11B1KCNH2AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080188478-A1 Compounds Useful In Therapy PFIZER INC. 2008-08-07 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-20080188478-A1 Compounds Useful In Therapy AVPR1A, AVPR1B, AVPR2 CYP11B2 278/4885CYP11B1 334/4885KCNH2 78/4885

“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.