SCHEMBL935280

SCHEMBL935280

Cc1ccc(NN=C(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.56
CTSB P07858 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.53
ALDH1A1 P00352 3/20 0.53
LMNA P02545 2/20 0.53
HTT P42858 2/20 0.53
RAB9A P51151 5/20 0.50
HPGD P15428 4/20 0.50
NPC1 O15118 4/20 0.50
MAPT P10636 3/20 0.50
GAA P10253 5/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
ALOX12 P18054 1/20 0.49
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA4 P22748 2/20 0.48
CA9 Q16790 2/20 0.48
PTGS2 P35354 1/20 0.47
TDP1 Q9NUW8 2/20 0.47

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
SCHEMBL934433 0.86 GAA (0.61) CTSLCTSBSMN1; SMN2ALDH1A1LMNA
SCHEMBL11986720 0.84 GAA (0.51) SMN1; SMN2ALDH1A1LMNAHTTRAB9A
SCHEMBL15187708 0.83 RAB9A (0.57) SMN1; SMN2ALDH1A1LMNARAB9AHPGD
SCHEMBL16863760 0.83 SMN1; SMN2 (0.56) CTSLCTSBSMN1; SMN2ALDH1A1LMNA
SCHEMBL18672224 0.82 GAA (0.63) SMN1; SMN2ALDH1A1LMNAHTTHPGD
SCHEMBL31213415 0.82 SMN1; SMN2 (0.51) CTSLCTSBSMN1; SMN2ALDH1A1LMNA
SCHEMBL933860 0.81 MEN1 (0.69) CTSLSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL29420498 0.81 MEN1 (0.49) SMN1; SMN2ALDH1A1LMNAHTTRAB9A
SCHEMBL3818727 0.81 MAPT (0.56) SMN1; SMN2ALDH1A1LMNAHTTRAB9A
SCHEMBL29420482 0.80 SMN1; SMN2 (0.54) CTSLCTSBSMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7557248-B2 Method of forming a carbon-heteroatom bond RHODIA CHIMIE (FR) 2009-07-07 US claimed
US-20070243999-A1 Method of Forming a Carbon-Heteroatom Bond RHODIA CHIMIE (FR) 2007-10-18 US claimed
CN-118880357-A Benzoxazine derivative and electrochemical synthesis method thereof 齐齐哈尔医学院 2024-11-01 CN disclosed
CN-114195676-B Biarylhydrazine compound and adduct thereof and application of compound in preparation of antitumor drugs 广州药本君安医药科技股份有限公司 2022-08-05 CN disclosed
CN-114195676-A Biarylhydrazine compound and adduct thereof and application of compound in preparation of antitumor drugs 广州药本君安医药科技股份有限公司 2022-03-18 CN disclosed
US-9983218-B2 Indole and indoline derivatives and methods of use thereof ABBVIE INC. (US) 2018-05-29 US disclosed
US-20180024144-A1 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF ABBVIE INC. (US) 2018-01-25 US disclosed
US-9625475-B2 Indole and indoline derivatives and methods of use thereof ABBVIE INC. (US) 2017-04-18 US disclosed
US-20150353550-A1 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF ABBVIE INC (US) 2015-12-10 US disclosed
US-9063126-B2 Indole and indoline derivatives and methods of use thereof ABBVIE INC. (US) 2015-06-23 US disclosed
EP-2344505-A2 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF Abbott Laboratories (US) 2011-07-20 EP disclosed
WO-2011008312-A2 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2011-01-20 WO disclosed
US-20100249105-A1 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2010-09-30 US disclosed
US-20100087471-A1 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2010-04-08 US disclosed
WO-2010036998-A2 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2010-04-01 WO disclosed
US-7557248-B2 Method of forming a carbon-heteroatom bond RHODIA CHIMIE (FR) 2009-07-07 US disclosed
US-20070243999-A1 Method of Forming a Carbon-Heteroatom Bond RHODIA CHIMIE (FR) 2007-10-18 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-20100249105-A1 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF IDO1, IDO2, TPH1 CTSL 4137/4885CTSB 3455/4885SMN1; SMN2 3913/4885
US-20180024144-A1 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF IDO1, IDO2, TPH1 CTSL 4137/4885CTSB 3455/4885SMN1; SMN2 3913/4885
US-20100087471-A1 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF IDO1, IDO2, TPH1 CTSL 4137/4885CTSB 3455/4885SMN1; SMN2 3913/4885
US-20150353550-A1 INDOLE AND INDOLINE DERIVATIVES AND METHODS OF USE THEREOF IDO1, IDO2, TPH1 CTSL 4137/4885CTSB 3455/4885SMN1; SMN2 3913/4885

“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.