SCHEMBL10008485

SCHEMBL10008485

O=C(CCc1ccccc1)Nc1ncc(Cc2c(F)c(F)c(F)c(F)c2F)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.57
▸ RAB9A P51151 4/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ MAPT P10636 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ HTT P42858 1/20 0.57
▸ TSHR P16473 1/20 0.53
▸ CCNE1 P24864 2/20 0.52
▸ CDK2 P24941 2/20 0.52
▸ CDK5 Q00535 2/20 0.52
▸ SIRT2 Q8IXJ6 2/20 0.52
▸ LMNA P02545 2/20 0.50
▸ TP53 P04637 2/20 0.50
▸ JAK2 O60674 1/20 0.50
▸ ZAP70 P43403 1/20 0.50
▸ SYK P43405 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.48
▸ ABL1 P00519 1/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ MAPK1 P28482 1/20 0.48

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
SCHEMBL10009377 0.89 SIRT2 (0.46) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10009245 0.88 SIRT2 (0.65) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10299103 0.87 KMT2A (0.57) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10008113 0.85 SCD (0.54) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10008705 0.83 JAK2 (0.69) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10009298 0.81 LMNA (0.55) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10007869 0.81 NPC1 (0.57) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10008543 0.81 KMT2A (0.65) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10008564 0.80 SIRT2 (0.63) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL10007768 0.79 ABL1 (0.61) NPC1RAB9AMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8883793-B2 Tubulin inhibitors and methods of using the same DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2014-11-11 — — US claimed
WO-2012092471-A2 NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2012-07-05 — — WO claimed
US-20120172374-A1 NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2012-07-05 — — US claimed
US-8883793-B2 Tubulin inhibitors and methods of using the same DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2014-11-11 — — US disclosed
US-8883793-B2 Tubulin inhibitors and methods of using the same DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2014-11-11 — — US disclosed
US-8883793-B2 Tubulin inhibitors and methods of using the same DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2014-11-11 — — US disclosed
US-20120172374-A1 NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2012-07-05 — — US disclosed
US-20120172374-A1 NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2012-07-05 — — US disclosed
US-20120172374-A1 NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2012-07-05 — — 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-20120172374-A1 NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME TUBB1, TUBA1C, TUBB NPC1 1216/4885RAB9A 1099/4885MEN1 740/4885

“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.

Send feedback