SCHEMBL5651015

SCHEMBL5651015

[NH]c1cccc(-c2nn(C3CCCCO3)c3ccc(-c4ncn(C(c5ccccc5)(c5ccccc5)c5ccccc5)n4)cc23)c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.33
ATR Q13535 3/20 0.32
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
DGAT2 Q96PD7 1/20 0.30

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
SCHEMBL5802425 0.90 RXRA (0.35) DRD1ATRRXRARXRBRXRG
SCHEMBL4605947 0.90 CMKLR1 (0.34) DRD1ATRRXRARXRBRXRG
SCHEMBL5374181 0.90 DRD1 (0.33) DRD1ATRRXRARXRBRXRG
SCHEMBL5373368 0.88 DRD1 (0.34) DRD1ATRRXRARXRBRXRG
SCHEMBL5377590 0.86 ALDH1A1 (0.34) DRD1
SCHEMBL5373140 0.86 CPT2 (0.35) DRD1ATRRXRARXRBRXRG
SCHEMBL5388680 0.86 CYP1A2 (0.37)
SCHEMBL5377905 0.85 DRD1 (0.34) DRD1ATRRXRARXRBRXRG
SCHEMBL5389006 0.85 DRD1 (0.30) DRD1RXRARXRBRXRG
SCHEMBL5374237 0.85 CNR1 (0.32) DRD1RXRARXRBRXRGDGAT2

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-7220771-B2 Methods of using indazole derivatives as JNK inhibitors SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-22 US disclosed
US-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, INC. 2004-04-22 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-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 DRD1 4315/4885ATR 1021/4885RXRA 988/4885

“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.