SCHEMBL29965900

SCHEMBL29965900

CC(=O)Nc1ccc(Nc2cc(-c3ccc(O)c(C)c3)[nH]n2)cc1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 17/20 0.80
CDK1 P06493 1/20 0.52
CDK2 P24941 1/20 0.52
RAB9A P51151 2/20 0.50
NPC1 O15118 1/20 0.50
NR1I2 O75469 1/20 0.50
AHR P35869 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL21262382 1.00 TNIK (0.80) TNIKCDK1CDK2RAB9ANPC1
SCHEMBL29965752 0.89 TNIK (1.00) TNIK
SCHEMBL21247927 0.89 TNIK (1.00) TNIK
SCHEMBL21262378 0.86 TNIK (0.74) TNIKCDK1CDK2
SCHEMBL29966090 0.86 TNIK (0.74) TNIKCDK1CDK2
SCHEMBL21262529 0.85 TNIK (0.76) TNIKRAB9ANPC1NR1I2AHR
SCHEMBL21262520 0.81 TNIK (0.74) TNIKCDK1CDK2RAB9ANPC1
SCHEMBL21262536 0.80 TNIK (0.74) TNIKRAB9A
SCHEMBL21247631 0.80 TNIK (1.00) TNIKRAB9ANPC1NR1I2AHR
SCHEMBL21262460 0.77 TNIK (0.80) TNIK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767297-B2 Compounds for inhibiting TNIK and medical uses thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-09-26 US disclosed
US-20230039679-A1 COMPOUNDS FOR INHIBITING TNIK AND MEDICAL USES THEREOF INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2023-02-09 US disclosed
US-11485711-B2 Compounds for inhibiting TNIK and medical uses thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2022-11-01 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 (3 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-11767297-B2 Compounds for inhibiting TNIK and medical uses thereof TNNI3K, TNK1, TNIK TNIK 3/4885CDK1 1478/4885CDK2 1936/4885
US-11485711-B2 Compounds for inhibiting TNIK and medical uses thereof TNNI3K, TNK1, TNIK TNIK 3/4885CDK1 1478/4885CDK2 1936/4885
US-20230039679-A1 COMPOUNDS FOR INHIBITING TNIK AND MEDICAL USES THEREOF TNNI3K, TNK1, TNIK TNIK 3/4885CDK1 1478/4885CDK2 1936/4885

“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.