SCHEMBL3848247

SCHEMBL3848247

Cn1cc(C(=O)C(=O)Nc2ccncc2)c2ccccc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.63
KMT2A Q03164 2/20 0.63
NPC1 O15118 2/20 0.63
MEN1 O00255 1/20 0.63
TUBB4A P04350 1/20 0.61
TUBB P07437 1/20 0.61
TUBA3C P0DPH7 1/20 0.61
TUBA1B P68363 1/20 0.61
TUBA4A P68366 1/20 0.61
TUBB4B P68371 1/20 0.61
TUBB3 Q13509 1/20 0.61
TUBB2A Q13885 1/20 0.61
TUBB8 Q3ZCM7 1/20 0.61
TUBA3E Q6PEY2 1/20 0.61
TUBA1A Q71U36 1/20 0.61
TUBA1C Q9BQE3 1/20 0.61
TUBB6 Q9BUF5 1/20 0.61
TUBB2B Q9BVA1 1/20 0.61
TUBB1 Q9H4B7 1/20 0.61
ALDH1A1 P00352 3/20 0.60

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
SCHEMBL11921550 0.89 RAB9A (0.69) RAB9AKMT2ANPC1MEN1ALDH1A1
SCHEMBL13044031 0.85 MEN1 (0.64) RAB9AKMT2ANPC1MEN1ALDH1A1
SCHEMBL13043504 0.82 MEN1 (0.60) RAB9AKMT2ANPC1MEN1ALDH1A1
SCHEMBL16384112 0.82 MEN1 (0.60) RAB9AKMT2ANPC1MEN1ALDH1A1
SCHEMBL13043491 0.81 RAB9A (0.54) RAB9AKMT2ANPC1MEN1ALDH1A1
SCHEMBL13044050 0.81 MEN1 (0.54) RAB9AKMT2ANPC1MEN1TUBB4A
SCHEMBL13044434 0.81 KMT2A (0.59) RAB9AKMT2ANPC1MEN1ALDH1A1
SCHEMBL15908288 0.81 TUBB4A (0.82) RAB9AKMT2ANPC1MEN1TUBB4A
SCHEMBL3166384 0.79 TUBB4A (0.85) KMT2AMEN1TUBB4ATUBBTUBA3C
SCHEMBL23625291 0.78 TUBB4A (0.82) RAB9AKMT2ANPC1MEN1TUBB4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0931063-B3 N-SUBSTITUTED INDOL-3-GLYOXYLAMID WITH ANTIASTHMATIC, ANTIALLERGIC AND IMMUNOSUPPRESSIVE/IMMUNOMODULATING EFFECT ZIOPHARM ONCOLOGY INC (US) 2009-04-08 EP claimed
EP-0931063-B1 N-SUBSTITUTED INDOL-3-GLYOXYLAMID WITH ANTIASTHMATIC, ANTIALLERGIC AND IMMUNOSUPPRESSIVE/IMMUNOMODULATING EFFECT BAXTER HEALTHCARE SA (CH) 2006-10-18 EP claimed
US-7579365-B2 Indolyl-3-glyoxylic acid derivatives having antitumor action ZIOPHRAM ONCOLOGY, INC. (US) 2009-08-25 US disclosed
US-20080027110-A1 Indolyl-3-glyoxylic acid derivatives having antitumor action ASTA MEDICA AKTIENGESELLSCHAFT 2008-01-31 US disclosed
US-20030023093-A1 United states patent office ASTA MEDICA AKTIENGESELLSCHAFT 2003-01-30 US disclosed
US-20020161025-A1 N-substituted indole-3glyoxylamides having anti-asthmatic, antiallergic and immunosuppressant/immuno-modulating action ZIOPHARM ONCOLOGY, INC. 2002-10-31 US disclosed
US-6232327-B1 AND PHYSIOLOGICALLY TOLERABLE ACID ADDITION SALTS, N-OXIDES ASTA MEDICA AKTIENGESELLSCHAFT (DE) 2001-05-15 US disclosed
US-6008231-A ANTIALLERGENS, ANTIHISTAMINES, IMMUNOSUPPRESSANTS, IMMUNOMODULATORS ASTA MEDICA AKTIENGESELLSCHGT (DE) 1999-12-28 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-20030023093-A1 United states patent office IDO1, IDO2, TDO2 RAB9A 4591/4885KMT2A 3506/4885NPC1 2176/4885
US-20080027110-A1 Indolyl-3-glyoxylic acid derivatives having antitumor action IDO1, IDO2, TDO2 RAB9A 4612/4885KMT2A 3037/4885NPC1 2538/4885
US-20020161025-A1 N-substituted indole-3glyoxylamides having anti-asthmatic, antiallergic and immunosuppressant/immuno-modulating action IDO1, IDO2, INMT RAB9A 3511/4885KMT2A 1157/4885NPC1 4190/4885

“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.