SCHEMBL7589837

SCHEMBL7589837

CCC(c1ccc(Cl)cc1)N(C)c1ncnc2[nH]ccc12

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 2/20 0.48
TTBK2 Q6IQ55 2/20 0.48
JAK3 P52333 10/20 0.47
CSF1R P07333 1/20 0.47
JAK1 P23458 9/20 0.45
AKT2 P31751 2/20 0.45
GSK3B P49841 1/20 0.45
JAK2 O60674 4/20 0.44
TYK2 P29597 2/20 0.44
AKT1 P31749 3/20 0.43
ROCK2 O75116 1/20 0.43
KCNH2 Q12809 1/20 0.43
AKT3 Q9Y243 1/20 0.43

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
SCHEMBL7855767 0.84 JAK3 (0.41) TTBK1TTBK2JAK3CSF1RJAK1
SCHEMBL7855768 0.80 TTBK1 (0.43) TTBK1TTBK2JAK3CSF1RJAK1
SCHEMBL3534021 0.79 CSF1R (0.53) JAK3CSF1RJAK1JAK2TYK2
SCHEMBL7087723 0.77 TTBK1 (0.46) TTBK1TTBK2JAK3CSF1RJAK1
SCHEMBL22877394 0.76 CSF1R (0.51) JAK3CSF1RJAK1JAK2TYK2
SCHEMBL20792859 0.76 CSF1R (0.51) JAK3CSF1RJAK1JAK2TYK2
SCHEMBL7855770 0.74 TTBK1 (0.43) TTBK1TTBK2JAK1AKT2GSK3B
SCHEMBL7090338 0.72 CSF1R (0.47) JAK3CSF1RJAK1JAK2TYK2
SCHEMBL26500579 0.72 CSF1R (0.67) JAK3CSF1RJAK1JAK2TYK2
SCHEMBL18493479 0.72 JAK3 (0.59) JAK3CSF1RJAK1JAK2TYK2

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-20020019526-A1 Pyrrolo[2,3-d]pyrimidine compounds PFIZER INC. 2002-02-14 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-20020019526-A1 Pyrrolo[2,3-d]pyrimidine compounds JAK1, JAK3, JAK2 TTBK1 126/4885TTBK2 242/4885JAK3 2/4885

“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.