SCHEMBL16948749

SCHEMBL16948749

NC(=O)/C=C/c1c[nH]c2ncc(-c3ccc(C(=O)c4ccc(Cl)cc4)nc3)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP3K11 Q16584 3/20 0.44
▸ PAK1 Q13153 1/20 0.41
▸ KIT P10721 2/20 0.40
▸ AXL P30530 4/20 0.39
▸ SGK1 O00141 3/20 0.39
▸ CAMKK2 Q96RR4 3/20 0.39
▸ CDK2 P24941 2/20 0.39
▸ CCNT1 O60563 1/20 0.39
▸ CCNA2 P20248 1/20 0.39
▸ CDK9 P50750 1/20 0.39
▸ AAK1 Q2M2I8 1/20 0.39
▸ MAP4K4 O95819 2/20 0.38
▸ ITK Q08881 2/20 0.38
▸ BTK Q06187 1/20 0.38
▸ PRKD3 O94806 2/20 0.38
▸ EGFR P00533 2/20 0.38
▸ NTRK1 P04629 2/20 0.38
▸ LCK P06239 2/20 0.38
▸ FYN P06241 2/20 0.38
▸ FLT4 P35916 2/20 0.38

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
SCHEMBL18238746 1.00 MAP3K11 (0.44) MAP3K11PAK1KITAXLSGK1
SCHEMBL18238184 0.95 MAP3K11 (0.41) MAP3K11PAK1KITAXLSGK1
SCHEMBL16948899 0.95 MAP3K11 (0.41) MAP3K11PAK1KITAXLSGK1
SCHEMBL18238580 0.92 MAP3K11 (0.44) MAP3K11PAK1KITAXLSGK1
SCHEMBL16949119 0.92 MAP3K11 (0.44) MAP3K11PAK1KITAXLSGK1
SCHEMBL18250480 0.90 MAP3K11 (0.44) MAP3K11KITAXLSGK1CAMKK2
SCHEMBL18238067 0.90 MAP3K11 (0.42) MAP3K11AXLSGK1CAMKK2CDK2
SCHEMBL16948923 0.90 MAP3K11 (0.42) MAP3K11AXLSGK1CAMKK2CDK2
SCHEMBL16949154 0.89 HSD17B14 (0.43) MAP3K11AXLSGK1CAMKK2CDK2
SCHEMBL18238840 0.89 HSD17B14 (0.43) MAP3K11AXLSGK1CAMKK2CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9499551-B2 Substituted pyrrolo[2,3-b]pyridines for treating cancer or inflammatory diseases CONFLUENCE LIFE SCIENCES, INC. (US) 2016-11-22 — — US disclosed
US-9499551-B2 Substituted pyrrolo[2,3-b]pyridines for treating cancer or inflammatory diseases CONFLUENCE LIFE SCIENCES, INC. (US) 2016-11-22 — — US disclosed
US-9499551-B2 Substituted pyrrolo[2,3-b]pyridines for treating cancer or inflammatory diseases CONFLUENCE LIFE SCIENCES, INC. (US) 2016-11-22 — — US disclosed
US-20150210705-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRROLOPYRAZINES FOR TREATING CANCER OR INFLAMMATORY DISEASES ACLARIS THERAPEUTICS, INC. 2015-07-30 — — 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-20150210705-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRROLOPYRAZINES FOR TREATING CANCER OR INFLAMMATORY DISEASES TPMT, MALT1, IRAK4 MAP3K11 181/4885PAK1 2708/4885KIT 875/4885

“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.

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