SCHEMBL27095922

SCHEMBL27095922

CN1CCC(CNc2ccc(CNc3ccc4cncc(Cl)c4c3)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 12/20 0.47
AXL P30530 1/20 0.44
CDK9 P50750 11/20 0.40
JAK2 O60674 2/20 0.39
IKBKB O14920 1/20 0.39
ROCK2 O75116 1/20 0.39
JAK3 P52333 1/20 0.39
CCND3 P30281 1/20 0.36
CDK6 Q00534 1/20 0.36
CHEK1 O14757 1/20 0.36
JAK1 P23458 2/20 0.36

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
SCHEMBL27096010 0.86 CCNT1 (0.40) CCNT1AXLCDK9CHEK1
SCHEMBL27096016 0.84 CCNT1 (0.45) CCNT1AXLCDK9JAK2JAK3
SCHEMBL27095975 0.82 CCNT1 (0.38) CCNT1AXLCDK9CHEK1
SCHEMBL27095944 0.81 CCNT1 (0.47) CCNT1AXLCDK9
SCHEMBL27095908 0.80 UTS2R (0.44) CCNT1CDK9JAK2JAK3CCND3
SCHEMBL27095897 0.80 CHEK1 (0.43) CCNT1AXLCDK9JAK2CHEK1
SCHEMBL27096031 0.80 CCNT1 (0.42) CCNT1CDK9ROCK2CCND3CDK6
SCHEMBL27095816 0.79 HDAC6 (0.45) CCNT1AXLCDK9CHEK1
SCHEMBL27096001 0.79 CCNT1 (0.42) CCNT1AXLCDK9CHEK1
SCHEMBL24493550 0.78 MRGPRX1 (0.44) CCNT1AXLCDK9

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-20240059691-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2024-02-22 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-20240059691-A1 ENZYME INHIBITORS SERPINB1, XDH, ACE CCNT1 644/4885AXL 4214/4885CDK9 499/4885

“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.