SCHEMBL21470715

SCHEMBL21470715

CN1CCN(Cc2ccc(NC(=O)N3CCc4ccc(Oc5c(F)cnc6[nH]c(-c7cnn(C)c7)cc56)cc4C3)cc2C(F)(F)F)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 4/20 0.45
▸ CSF1R P07333 1/20 0.45
▸ SRC P12931 5/20 0.44
▸ ABL1 P00519 5/20 0.44
▸ FGFR4 P22455 3/20 0.42
▸ CDK1 P06493 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ CDK8 P49336 1/20 0.42
▸ RET P07949 1/20 0.42
▸ CCDC6 Q16204 1/20 0.42
▸ BCR P11274 1/20 0.42
▸ EGFR P00533 3/20 0.42
▸ BRAF P15056 3/20 0.42
▸ HCK P08631 1/20 0.42
▸ BTK Q06187 1/20 0.42

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
SCHEMBL21470719 0.96 HCK (0.46) KITCSF1RSRCABL1RET
SCHEMBL21470839 0.96 KIT (0.43) KITCSF1RSRCABL1FGFR4
SCHEMBL21470533 0.92 KIT (0.44) KITCSF1RSRCABL1
SCHEMBL21471041 0.92 SRC (0.51) KITCSF1RSRCABL1FGFR4
SCHEMBL21471038 0.92 KIT (0.47) KITSRCABL1FGFR4CDK1
SCHEMBL21470718 0.92 KIT (0.40) KITCSF1RSRCABL1FGFR4
SCHEMBL21471042 0.91 RET (0.49) KITCSF1RSRCABL1RET
SCHEMBL23353703 0.90 ABL1 (0.43) KITCSF1RSRCABL1FGFR4
SCHEMBL21470838 0.90 ABL1 (0.48) KITCSF1RSRCABL1FGFR4
SCHEMBL21470535 0.89 ABL1 (0.43) KITCSF1RSRCABL1FGFR4

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-20210139484-A1 DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS GOSSAMER BIO SERVICES INC (US) 2021-05-13 — — US disclosed
US-20210139484-A1 DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS GOSSAMER BIO SERVICES INC (US) 2021-05-13 — — US disclosed
WO-2019200120-A1 DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS LYCERA CORPORATION (US) 2019-10-17 — — WO 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-20210139484-A1 DIHYDROISOQUINOLINE-2(1H)-CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS ULK1, PHKG2, PHKG1 KIT 1130/4885CSF1R 2818/4885SRC 1670/4885

“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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