SCHEMBL15960740

SCHEMBL15960740

Cc1cc2c(Cl)ncnc2cc1OCCCN1CCC2(CC1)COC2

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.51
EGFR P00533 6/20 0.49
SRC P12931 3/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
ENPP1 P22413 1/20 0.41

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
SCHEMBL15960741 0.89 KDR (0.61) KDREGFRSRCFGFR1FLT1
SCHEMBL15960728 0.85 KDR (0.51) KDREGFRSRC
SCHEMBL11953085 0.85 EGFR (0.48) KDREGFRSRCFGFR1FLT1
SCHEMBL11953082 0.84 SRC (0.49) KDREGFRSRCFGFR1FLT1
SCHEMBL10102456 0.84 EGFR (0.49) KDREGFRSRCFGFR1FLT1
SCHEMBL28486124 0.83 KDR (0.51) KDREGFRSRCFGFR1FLT1
SCHEMBL28051384 0.82 EGFR (0.53) KDREGFRSRCFGFR1FLT1
SCHEMBL15960736 0.81 KDR (0.60) KDRFLT1FLT4
SCHEMBL28487050 0.81 KDR (0.52) KDREGFRSRCFGFR1FLT1
SCHEMBL15960725 0.76 KDR (0.59) KDREGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180133225-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA BIO, Inc. 2018-05-17 US disclosed
US-9877970-B2 Therapeutic compounds and uses thereof KALA PHARMACEUTICALS, INC. (US) 2018-01-30 US disclosed
US-9827248-B2 Therapeutic compounds and uses thereof KALA PHARMACEUTICALS, INC. (US) 2017-11-28 US disclosed
US-20160235761-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA BIO, Inc. 2016-08-18 US disclosed
US-20160237093-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA BIO, Inc. 2016-08-18 US disclosed
US-9353122-B2 Therapeutic compounds and uses thereof KALA PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed
US-20140235634-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA PHARMACEUTICALS, INC. (US) 2014-08-21 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 (4 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-20180133225-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF MUC1, CFTR, SLC26A4 KDR 4095/4885EGFR 829/4885SRC 4259/4885
US-20160235761-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF MUC1, CFTR, SLC26A4 KDR 4095/4885EGFR 829/4885SRC 4259/4885
US-20160237093-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF MUC1, CFTR, SLC26A4 KDR 4095/4885EGFR 829/4885SRC 4259/4885
US-20140235634-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF MUC1, CFTR, SLC26A4 KDR 4095/4885EGFR 829/4885SRC 4259/4885

“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.