SCHEMBL14617528

SCHEMBL14617528

CB(O)N1CCN(c2cccc(N)c2)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2C P18825 1/20 0.62
▸ MAPT P10636 4/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ LMNA P02545 2/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ CASP1 P29466 1/20 0.43
▸ CASP7 P55210 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MLYCD O95822 1/20 0.41
▸ HTR1A P08908 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ DDB1 Q16531 1/20 0.40
▸ CRBN Q96SW2 1/20 0.40
▸ HTR2A P28223 1/20 0.40

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
SCHEMBL6942579 0.82 ADRA2C (0.80) ADRA2CMAPTALDH1A1LMNAALOX12
SCHEMBL12556830 0.81 MAPT (0.58) ADRA2CMAPTALDH1A1LMNAALOX12
SCHEMBL9915610 0.80 CHRNA7 (0.50) MAPTALDH1A1LMNASMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL7077636 0.80 ADRA2C (0.77) ADRA2CMAPTALDH1A1LMNAALOX12
SCHEMBL448110 0.77 ADRA2C (1.00) ADRA2CMAPTALDH1A1LMNAALOX12
SCHEMBL2627250 0.76 ADRA2C (0.71) ADRA2CMAPTALDH1A1LMNAALOX12
SCHEMBL14617529 0.76 MAPT (0.54) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL16209754 0.75 ADRA2C (0.96) ADRA2CMAPTALDH1A1LMNAALOX12
SCHEMBL533024 0.74 ADRA2C (0.68) ADRA2CMAPTALDH1A1LMNAALOX12
SCHEMBL15289763 0.74 ADRA2C (0.68) ADRA2CMAPTALDH1A1LMNAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9421205-B2 FAK inhibitors Cancer Therapeutics CRC Pty Ltd. (AU) 2016-08-23 — — US disclosed
US-9266864-B2 VEGFR3 inhibitors CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2016-02-23 — — US disclosed
US-9238644-B2 VEGFR3 inhibitors CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2016-01-19 — — US disclosed
US-20160009686-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2016-01-14 — — US disclosed
US-20150231135-A1 FAK INHIBITORS Cancer Therapeutics CRC Pty Ltd. (AU) 2015-08-20 — — US disclosed
US-20150225377-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2015-08-13 — — US disclosed
US-9012461-B2 FAK inhibitors CANCER THERAPEUTICS CRC PTY LTD (AU) 2015-04-21 — — US disclosed
US-20140080798-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-03-20 — — US disclosed
US-20140073620-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-03-13 — — US disclosed
US-20130017194-A1 FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2013-01-17 — — 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 (6 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-20130017194-A1 FAK INHIBITORS PTK2, CTTN, SRC ADRA2C 1778/4885MAPT 2189/4885ALDH1A1 3192/4885
US-20150225377-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR ADRA2C 1585/4885MAPT 2971/4885ALDH1A1 1985/4885
US-20160009686-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR ADRA2C 3240/4885MAPT 3347/4885ALDH1A1 2289/4885
US-20140080798-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR ADRA2C 3261/4885MAPT 3456/4885ALDH1A1 2096/4885
US-20140073620-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR ADRA2C 3240/4885MAPT 3347/4885ALDH1A1 2289/4885
US-20150231135-A1 FAK INHIBITORS PTK2, CTTN, SRC ADRA2C 2231/4885MAPT 2447/4885ALDH1A1 2762/4885

“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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