SCHEMBL2056779

SCHEMBL2056779

Cc1ccc(N)c(N)c1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.57
POLB P06746 1/20 0.50
CYP3A4 P08684 8/20 0.43
ALDH1A1 P00352 5/20 0.43
TDP1 Q9NUW8 5/20 0.43
TSHR P16473 5/20 0.43
CASP1 P29466 1/20 0.43
NOS3 P29474 1/20 0.40
NOS2 P35228 1/20 0.40
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TP53 P04637 2/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38

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
Hydrochloric Acid SCHEMBL3725463 0.97 CD44 (0.55) CD44POLBCYP3A4ALDH1A1TDP1
SCHEMBL409314 0.87 POLB (0.61) CD44POLBCYP3A4ALDH1A1TDP1
Hydrochloric Acid SCHEMBL8125648 0.83 POLB (0.58) CD44POLBCYP3A4ALDH1A1TDP1
Methyl Alcohol SCHEMBL7119741 0.80 POLB (0.55) CD44POLBCYP3A4ALDH1A1TDP1
SCHEMBL135806 0.79 CYP3A4 (0.43) CD44CYP3A4ALDH1A1TDP1TSHR
SCHEMBL30884128 0.79 CYP3A4 (0.43) CD44CYP3A4ALDH1A1TDP1TSHR
SCHEMBL23668109 0.79 POLB (0.62) CD44POLBCYP3A4ALDH1A1TDP1
SCHEMBL43624 0.79 POLB (0.62) CD44POLBCYP3A4ALDH1A1TDP1
SCHEMBL34364 0.79 POLB (0.48) CD44POLBCYP3A4ALDH1A1TDP1
Ammonia Solution, Strong SCHEMBL18426057 0.77 POLB (0.59) CD44POLBCYP3A4ALDH1A1TDP1

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 167 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4373608-A1 ENVIRONMENTALLY FRIENDLY MICROCAPSULES AND A METHOD FOR THE PRODUCTION THEREOF Follmann GmbH & Co. KG (DE) 2024-05-29 EP claimed
CN-117820171-A Process method for synthesizing toluene triisocyanate by using triamino toluene phosgene 中国融通资源开发集团有限公司 2024-04-05 CN claimed
WO-2023002028-A1 ENVIRONMENTALLY FRIENDLY MICROCAPSULES AND A METHOD FOR THE PRODUCTION THEREOF FOLLMANN GMBH & CO. KG (DE) 2023-01-26 WO claimed
CN-112011168-A Water-oil polyurethane material, preparation process and application thereof 四川童燊防水工程有限公司 2020-12-01 CN claimed
CN-112011024-A TS-29 hydrophilic polyurethane grouting material and preparation process thereof 四川童燊防水工程有限公司 2020-12-01 CN claimed
CN-111097294-A Preparation method of nanofiltration membrane for reclaimed water treatment 宁波水艺膜科技发展有限公司 2020-05-05 CN claimed
CN-108602029-A Stable facilitated transfer membrane for olefin/alkane separation 环球油品公司 2018-09-28 CN claimed
CN-107986925-A A kind of high-energy-density reactivity elastomer and preparation method thereof 中国工程物理研究院化工材料研究所 2018-05-04 CN claimed
EP-1054031-A2 Increasing the molecular weight and modification of condensation polymers Ciba SC Holding AG (CH) 2000-11-22 EP claimed
EP-0072915-B1 PROCESS FOR PREPARING 2,4,6-TRIISOCYANATOTOLUENE BASF Aktiengesellschaft (DE) 1986-05-21 EP claimed
US-4238130-A Pressure-sensitive or heat-sensitive recording material CIBA-GEIGY CORPORATION (US) 1980-12-09 US claimed
US-12616960-B2 Catalyst system for producing aromatic amines BASF SE (DE) 2026-05-05 US disclosed
EP-4373608-B1 ENVIRONMENTALLY FRIENDLY MICROCAPSULES AND A METHOD FOR THE PRODUCTION THEREOF FOLLMANN GMBH & CO KG (DE) 2025-05-14 EP disclosed
EP-4308628-B1 ALKYD RESIN, COATING COMPOSITION, AND SUBSTRATE COATED WITH SUCH COATING COMPOSITON AKZO NOBEL COATINGS INT BV (NL) 2025-04-30 EP disclosed
WO-2025051675-A1 CATALYST FOR THE PRODUCTION OF AROMATIC AMINES HAVING A DEFINED FINE FRACTION BASF SE (DE) 2025-03-13 WO disclosed
EP-0082394-A2 A process for the production of aminophthalides and amino benzoic acids STERLING DRUG INC. (US) 1983-06-29 EP disclosed
EP-0072915-A2 Process for preparing 2,4,6-triisocyanatotoluene BASF Aktiengesellschaft (DE) 1983-03-02 EP disclosed
US-4238130-A Pressure-sensitive or heat-sensitive recording material CIBA-GEIGY CORPORATION (US) 1980-12-09 US disclosed
US-4238130-A Pressure-sensitive or heat-sensitive recording material CIBA-GEIGY CORPORATION (US) 1980-12-09 US disclosed
US-4096165-A Method of manufacturing aromatic isocyanates ALLIED CHEMICAL CORPORATION (US) 1978-06-20 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-12616960-B2 Catalyst system for producing aromatic amines AOC2, SCO2, CHRM2 CD44 2425/4885POLB 309/4885CYP3A4 735/4885

“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.